Showing results for G
Total number of hits: 155
Click on results for more details:
PCNDIDG0001
Gaillardin
Canonical SMILES: CC1=CC2C(CC3C1C(CC3(C)O)OC(=O)C)C(=C)C(=O)O2
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0002
Galactoarabinan
Canonical SMILES: CC1C(C(C(C(O1)CO)O)OC2C(C(C(C(O2)COC3C(C(C(CO3)O)OC)O)O)OC)O)O
Class: Organooxygen compounds
Disease: AD
PCNDIDG0003
Galanal A
Canonical SMILES: CC1(CCCC2(C1CCC3(C2CC=C(CC3O)C=O)C=O)C)C
Class: Organooxygen compounds
Disease: AD, PD
PCNDIDG0004
Galangin
Canonical SMILES: C1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O
Class: Flavonoids
Disease: AD, PD
PCNDIDG0005
Galantamine
Canonical SMILES: CN1CCC23C=CC(CC2OC4=C(C=CC(=C34)C1)OC)O
Class: Amaryllidaceae alkaloids
Disease: AD, PD
PCNDIDG0006
Galbacin
Canonical SMILES: CC1C(C(OC1C2=CC3=C(C=C2)OCO3)C4=CC5=C(C=C4)OCO5)C
Class: Furanoid lignans
Disease: AD
PCNDIDG0007
Galgravin
Canonical SMILES: CC1C(C(OC1C2=CC(=C(C=C2)OC)OC)C3=CC(=C(C=C3)OC)OC)C
Class: Furanoid lignans
Disease: AD, PD
PCNDIDG0008
Gallic Acid
Canonical SMILES: C1=C(C=C(C(=C1O)O)O)C(=O)O
Class: Benzene and substituted derivatives
Disease: AD, PD
PCNDIDG0009
Gallocatechin
Canonical SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O
Class: Flavonoids
Disease: AD, Epilepsy
PCNDIDG0010
Gallocatechin-(4alpha->8)-epigallocatechin
Canonical SMILES: C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C(=C5)O)O)O)O)O)O)C6=CC(=C(C(=C6)O)O)O)O
Class: Flavonoids
Disease: AD
PCNDIDG0011
Gallocatechin-(4alpha->8)-gallocatechin-(4alpha->8)-gallocatechin
Canonical SMILES: C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC(=C(C(=C7)O)O)O)O)C8=CC(=C(C(=C8)O)O)O)O)O)O)C9=CC(=C(C(=C9)O)O)O)O
Class: Flavonoids
Disease: AD
PCNDIDG0012
Gallotannin
Canonical SMILES: C1=C(C=C(C(=C1O)O)O)C(=O)OC2=CC(=CC(=C2O)O)C(=O)OCC3C(C(C(C(O3)OC(=O)C4=CC(=C(C(=C4)OC(=O)C5=CC(=C(C(=C5)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6)OC(=O)C7=CC(=C(C(=C7)O)O)O)O)O)OC(=O)C8=CC(=C(C(=C8)OC(=O)C9=CC(=C(C(=C9)O)O)O)O)O)OC(=O)C1=CC(=C(C(=C1)OC(=O)C1=CC(=C(C(=C1)O)O)O)O)O
Class: Tannins
Disease: AD
PCNDIDG0013
Gambirine
Canonical SMILES: CCC1CN2CCC3=C(C2CC1C(=COC)C(=O)OC)NC4=C3C(=CC=C4)O
Class: Corynanthean-type alkaloids
Disease: AD
PCNDIDG0014
Gamma-Aminobutyric Acid
Canonical SMILES: C(CC(=O)O)CN
Class: Carboxylic acids and derivatives
Disease: Epilepsy
PCNDIDG0015
gamma-Aminobutyric acid hydrochloride
Canonical SMILES: C(CC(=O)O)CN.Cl
Class: Carboxylic acids and derivatives
Disease: AD
PCNDIDG0016
gamma-Asarone
Canonical SMILES: COC1=CC(=C(C=C1CC=C)OC)OC
Class: Phenol ethers
Disease: AD, PD
PCNDIDG0017
gamma-Butyrolactone
Canonical SMILES: C1CC(=O)OC1
Class: Lactones
Disease: AD
PCNDIDG0018
gamma-Curcumene
Canonical SMILES: CC1=CC=C(CC1)C(C)CCC=C(C)C
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0019
gamma-Fagarine
Canonical SMILES: COC1=CC=CC2=C1N=C3C(=C2OC)C=CO3
Class: Quinolines and derivatives
Disease: PD, Epilepsy
PCNDIDG0020
gamma-Linolenic acid
Canonical SMILES: CCCCCC=CCC=CCC=CCCCCC(=O)O
Class: Fatty Acyls
Disease: AD
PCNDIDG0021
Gamma-nonalactone
Canonical SMILES: CCCCCC1CCC(=O)O1
Class: Lactones
Disease: AD
PCNDIDG0022
gamma-Oryzanol
Canonical SMILES: CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)OC(=O)C=CC6=CC(=C(C=C6)O)OC)C)C
Class: Steroids and steroid derivatives
Disease: AD
PCNDIDG0023
gamma-Selinene
Canonical SMILES: CC(=C1CCC2(CCCC(=C)C2C1)C)C
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0024
gamma-Terpinene
Canonical SMILES: CC1=CCC(=CC1)C(C)C
Class: Unsaturated hydrocarbons
Disease: AD, PD
PCNDIDG0025
gamma-Terpineol
Canonical SMILES: CC(=C1CCC(CC1)(C)O)C
Class: Prenol lipids
Disease: AD
PCNDIDG0026
gamma-Terpinyl acetate
Canonical SMILES: CC(=C1CCC(CC1)(C)OC(=O)C)C
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0027
gamma-Tocopherol
Canonical SMILES: CC1=C(C=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)O
Class: Prenol lipids
Disease: PD, Epilepsy
PCNDIDG0028
gamma-Tocotrienol
Canonical SMILES: CC1=C(C=C2CCC(OC2=C1C)(C)CCC=C(C)CCC=C(C)CCC=C(C)C)O
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0029
Gamma-undecalactone
Canonical SMILES: CCCCCCCC1CCC(=O)O1
Class: Lactones
Disease: AD
PCNDIDG0030
Gancaonin A
Canonical SMILES: CC(=CCC1=C(C2=C(C=C1O)OC=C(C2=O)C3=CC=C(C=C3)OC)O)C
Class: Isoflavonoids
Disease: AD, PD
PCNDIDG0031
Gancaonin B
Canonical SMILES: CC(=CCC1=C(C2=C(C=C1O)OC=C(C2=O)C3=CC(=C(C=C3)OC)O)O)C
Class: Isoflavonoids
Disease: AD
PCNDIDG0032
Gancaonin G
Canonical SMILES: CC(=CCC1=C(C=C2C(=C1O)C(=O)C(=CO2)C3=CC=C(C=C3)O)OC)C
Class: Isoflavonoids
Disease: AD
PCNDIDG0033
Gancaonin H
Canonical SMILES: CC(=CCC1=C(C2=C(C=C1O)OC=C(C2=O)C3=CC4=C(C(=C3)O)OC(C=C4)(C)C)O)C
Class: Isoflavonoids
Disease: AD
PCNDIDG0034
Ganhuangenin
Canonical SMILES: COC1=C(C=CC(=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)OC)O)O
Class: Flavonoids
Disease: AD
PCNDIDG0035
garcinone B
Canonical SMILES: CC(=CCC1=C(C2=C(C=C1O)OC3=C(C2=O)C4=C(C(=C3)O)OC(C=C4)(C)C)O)C
Class: Benzopyrans
Disease: AD
PCNDIDG0036
Gardenin D
Canonical SMILES: COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C(=C3O2)OC)OC)OC)O)O
Class: Flavonoids
Disease: AD
PCNDIDG0037
Gastrodin
Canonical SMILES: C1=CC(=CC=C1CO)OC2C(C(C(C(O2)CO)O)O)O
Class: Organooxygen compounds
Disease: PD, Epilepsy
PCNDIDG0038
Gaultherin
Canonical SMILES: COC(=O)C1=CC=CC=C1OC2C(C(C(C(O2)COC3C(C(C(CO3)O)O)O)O)O)O
Class: Organooxygen compounds
Disease: AD
PCNDIDG0039
Gedunine
Canonical SMILES: CC(=O)OC1CC2C(C(=O)C=CC2(C3C1(C45C(O4)C(=O)OC(C5(CC3)C)C6=COC=C6)C)C)(C)C
Class: Prenol lipids
Disease: Encephalitits, Meningitis
PCNDIDG0040
Gelsemicine
Canonical SMILES: CCC1C2CC3C4(CC(C2CO3)N1)C5=C(C=C(C=C5)OC)N(C4=O)OC
Class: Gelsemium alkaloids
Disease: AD
PCNDIDG0041
Gelsemin
Canonical SMILES: CN1CC2(C3CC4C5(C2C1C3CO4)C6=CC=CC=C6NC5=O)C=C
Class: Gelsemium alkaloids
Disease: AD
PCNDIDG0042
Gemin A
Canonical SMILES: C1C2C(C3C(C(O2)OC(=O)C4=CC(=C(C(=C4OC5=CC(=CC(=C5O)O)C(=O)OC6C(C(C7C(O6)COC(=O)C8=CC(=C(C(=C8C9=C(C(=C(C=C9C(=O)O7)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O3)O)O)O)O)O)O)OC(=O)C2=CC(=C(C(=C2C2=C(C(=C(C=C2C(=O)O1)O)O)O)O)O)O
Class: Tannins
Disease: AD
PCNDIDG0043
Genipin
Canonical SMILES: COC(=O)C1=COC(C2C1CC=C2CO)O
Class: Prenol lipids
Disease: AD
PCNDIDG0044
Geniposide
Canonical SMILES: COC(=O)C1=COC(C2C1CC=C2CO)OC3C(C(C(C(O3)CO)O)O)O
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0045
Geniposidic acid
Canonical SMILES: C1C=C(C2C1C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)O)CO
Class: Prenol lipids
Disease: AD
PCNDIDG0046
Genistein
Canonical SMILES: C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O
Class: Isoflavonoids
Disease: AD, Encephalitits, Meningitis, Multiple sclreosis
PCNDIDG0047
Genistin
Canonical SMILES: C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)CO)O)O)O)O
Class: Isoflavonoids
Disease: AD
PCNDIDG0048
Genkwanin
Canonical SMILES: COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O
Class: Flavonoids
Disease: AD
PCNDIDG0049
Gentiacaulein
Canonical SMILES: COC1=CC(=C2C(=C1)OC3=C(C2=O)C(=C(C=C3)O)OC)O
Class: Benzopyrans
Disease: AD, PD
PCNDIDG0050
Gentianaine
Canonical SMILES: C1COC(=O)C(=C1O)C=N
Class: Pyrans
Disease: AD
PCNDIDG0051
Gentianamine
Canonical SMILES: C=CC1=CN=CC2=C1C(COC2=O)CO
Class: Pyranopyridines
Disease: AD
PCNDIDG0052
Gentianidine
Canonical SMILES: CC1=CC2=C(C=N1)C(=O)OCC2
Class: Pyranopyridines
Disease: AD, PD
PCNDIDG0053
Gentianine
Canonical SMILES: C=CC1=CN=CC2=C1CCOC2=O
Class: Pyranopyridines
Disease: AD, PD
PCNDIDG0054
Gentiatibetine
Canonical SMILES: CC1=NC=CC2=C1C(OCC2)O
Class: Pyranopyridines
Disease: AD
PCNDIDG0055
Gentiopicroside
Canonical SMILES: C=CC1C(OC=C2C1=CCOC2=O)OC3C(C(C(C(O3)CO)O)O)O
Class: Organooxygen compounds
Disease: AD, PD
PCNDIDG0056
Gentisein
Canonical SMILES: C1=CC2=C(C=C1O)C(=O)C3=C(C=C(C=C3O2)O)O
Class: Benzopyrans
Disease: AD
PCNDIDG0057
Gentisin
Canonical SMILES: COC1=CC(=C2C(=C1)OC3=C(C2=O)C=C(C=C3)O)O
Class: Benzopyrans
Disease: AD
PCNDIDG0058
Geraniol
Canonical SMILES: CC(=CCCC(=CCO)C)C
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0059
Geranyl isobutyrate
Canonical SMILES: CC(C)C(=O)OCC=C(C)CCC=C(C)C
Class: Fatty Acyls
Disease: AD
PCNDIDG0060
Geranyl propionate
Canonical SMILES: CCC(=O)OCC=C(C)CCC=C(C)C
Class: Fatty Acyls
Disease: AD
PCNDIDG0061
Geranylgeraniol
Canonical SMILES: CC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C
Class: Prenol lipids
Disease: AD
PCNDIDG0062
Germacra-1(10),4,11(13)-triene-12,14-dioic acid, 2-beta,6-alpha,8-alpha-trihydroxy-, 12,6:14,2-dilactone, methacrylate, (E)-
Canonical SMILES: CC1=CC2C(C(CC3=CC(C1)OC3=O)OC(=O)C(=C)C)C(=C)C(=O)O2
Class: Prenol lipids
Disease: PD, Epilepsy
PCNDIDG0063
Germacrene D
Canonical SMILES: CC1=CCCC(=C)C=CC(CC1)C(C)C
Class: Prenol lipids
Disease: AD
PCNDIDG0064
Gibberellin A7
Canonical SMILES: CC12C(C=CC3(C1C(C45C3CCC(C4)C(=C)C5)C(=O)O)OC2=O)O
Class: Prenol lipids
Disease: AD
PCNDIDG0065
Gibberellin A95
Canonical SMILES: CC12CC=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O
Class: Prenol lipids
Disease: AD
PCNDIDG0066
gibberellin A97
Canonical SMILES: CC12CC(CC(C1C(C34C2CCC(C3)(C(=C)C4)O)C(=O)[O-])(C)C(=O)[O-])O
Class: Prenol lipids
Disease: Epilepsy
PCNDIDG0067
Gingerdiol
Canonical SMILES: CCCCCC(CC(CCC1=CC(=C(C=C1)O)OC)O)O
Class: Phenols
Disease: AD
PCNDIDG0068
Gingerdione
Canonical SMILES: CCCCCC(=O)CC(=O)CCC1=CC(=C(C=C1)O)OC
Class: Phenols
Disease: AD, PD
PCNDIDG0069
Gingerenone A
Canonical SMILES: COC1=C(C=CC(=C1)CCC=CC(=O)CCC2=CC(=C(C=C2)O)OC)O
Class: Diarylheptanoids
Disease: AD
PCNDIDG0070
Gingerenone B
Canonical SMILES: COC1=CC(=CC(=C1O)OC)CCC=CC(=O)CCC2=CC(=C(C=C2)O)OC
Class: Diarylheptanoids
Disease: AD
PCNDIDG0071
Gingerol
Canonical SMILES: CCCCCC(CC(=O)CCC1=CC(=C(C=C1)O)OC)O
Class: Phenols
Disease: PD
PCNDIDG0072
Ginkgetin
Canonical SMILES: COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC)O)C4=C(C=C(C5=C4OC(=CC5=O)C6=CC=C(C=C6)O)O)O
Class: Flavonoids
Disease: AD, PD
PCNDIDG0073
Ginkgolic acid
Canonical SMILES: CCCCCCC=CCCCCCCCC1=C(C(=CC=C1)O)C(=O)O
Class: Benzene and substituted derivatives
Disease: AD, PD
PCNDIDG0074
Ginkgolide B
Canonical SMILES: CC1C(=O)OC2C1(C34C(=O)OC5C3(C2O)C6(C(C5)C(C)(C)C)C(C(=O)OC6O4)O)O
Class: Prenol lipids
Disease: AD, Encephalitits, Meningitis
PCNDIDG0075
ginkgolide-A
Canonical SMILES: CC1C(=O)OC2C1(C34C(=O)OC5C3(C2)C6(C(C5)C(C)(C)C)C(C(=O)OC6O4)O)O
Class: Prenol lipids
Disease: AD
PCNDIDG0076
ginkgolide-C
Canonical SMILES: CC1C(=O)OC2C1(C34C(=O)OC5C3(C2O)C6(C(C5O)C(C)(C)C)C(C(=O)OC6O4)O)O
Class: Prenol lipids
Disease: AD
PCNDIDG0077
ginkgolide-J
Canonical SMILES: CC1C(=O)OC2C1(C34C(=O)OC5C3(C2)C6(C(C5O)C(C)(C)C)C(C(=O)OC6O4)O)O
Class: Prenol lipids
Disease: AD
PCNDIDG0078
Ginsenoside F1
Canonical SMILES: CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CC(C4C3(CCC(C4(C)C)O)C)O)C)O)C)OC5C(C(C(C(O5)CO)O)O)O)C
Class: Prenol lipids
Disease: AD
PCNDIDG0079
Ginsenoside rb1
Canonical SMILES: CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)C)C)O)C)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O)C
Class: Prenol lipids
Disease: PD
PCNDIDG0080
Ginsenoside Rf
Canonical SMILES: CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CC(C4C3(CCC(C4(C)C)O)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)C)O)C)O)C
Class: Prenol lipids
Disease: AD
PCNDIDG0081
Ginsenoside RG1
Canonical SMILES: CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CC(C4C3(CCC(C4(C)C)O)C)OC5C(C(C(C(O5)CO)O)O)O)C)O)C)OC6C(C(C(C(O6)CO)O)O)O)C
Class: Prenol lipids
Disease: Meningitis
PCNDIDG0082
Ginsenoside Rh2
Canonical SMILES: CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)O)C)C)O)C)O)C
Class: Prenol lipids
Disease: AD, Huntington disease, Myasthenia Gravis
PCNDIDG0083
Ginsenoside Ro
Canonical SMILES: CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(C(O6)C(=O)O)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)OC8C(C(C(C(O8)CO)O)O)O)C
Class: Prenol lipids
Disease: AD
PCNDIDG0084
ginsenoside-Rd
Canonical SMILES: CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CC(C4C3(CCC(C4(C)C)O)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)C)O)C)OC7C(C(C(C(O7)CO)O)O)O)C
Class: Prenol lipids
Disease: AD
PCNDIDG0085
Ginsenosides
Canonical SMILES: CC(=CCCC(C)(C1CCC2(C1CCC3C2(CCC4C3(CCC(C4(C)C)O)C)C)C)O)C
Class: Prenol lipids
Disease: AD
PCNDIDG0086
Ginsenoyne A
Canonical SMILES: C=CCCCCCC1C(O1)CC#CC#CC(C=C)O
Class: Fatty Acyls
Disease: AD
PCNDIDG0087
Ginsenoyne B
Canonical SMILES: C=CCCCCCC(C(CC#CC#CC(C=C)O)O)Cl
Class: Halohydrins
Disease: AD
PCNDIDG0088
Ginsenoyne D
Canonical SMILES: CCCCCCCC1C(O1)CC#CC#CC(CC)O
Class: Fatty Acyls
Disease: AD
PCNDIDG0089
Ginsenoyne E
Canonical SMILES: CCCCCCCC1C(O1)CC#CC#CC(=O)C=C
Class: Organooxygen compounds
Disease: AD
PCNDIDG0090
Girinimbine
Canonical SMILES: CC1=CC2=C(C3=C1OC(C=C3)(C)C)NC4=CC=CC=C42
Class: Indoles and derivatives
Disease: AD
PCNDIDG0091
Gitogenin
Canonical SMILES: CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CC(C(C6)O)O)C)C)C)OC1
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0092
Glabranin
Canonical SMILES: CC(=CCC1=C2C(=C(C=C1O)O)C(=O)CC(O2)C3=CC=CC=C3)C
Class: Flavonoids
Disease: AD
PCNDIDG0093
Glabrene
Canonical SMILES: CC1(C=CC2=C(C=CC(=C2O1)C3=CC4=C(C=C(C=C4)O)OC3)O)C
Class: Isoflavonoids
Disease: AD
PCNDIDG0094
Glabridin
Canonical SMILES: CC1(C=CC2=C(O1)C=CC3=C2OCC(C3)C4=C(C=C(C=C4)O)O)C
Class: Isoflavonoids
Disease: AD, PD
PCNDIDG0095
Glabrone
Canonical SMILES: CC1(C=CC2=C(O1)C=CC(=C2O)C3=COC4=C(C3=O)C=CC(=C4)O)C
Class: Isoflavonoids
Disease: AD, PD
PCNDIDG0096
Glaucine
Canonical SMILES: CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)OC)OC)OC
Class: Aporphines
Disease: AD, PD
PCNDIDG0097
Glaziovine
Canonical SMILES: CN1CCC2=CC(=C(C3=C2C1CC34C=CC(=O)C=C4)O)OC
Class: Proaporphines
Disease: AD
PCNDIDG0098
Glechomanolide
Canonical SMILES: CC1=CCC2=C(C(=O)OC2CC(=CCC1)C)C
Class: Prenol lipids
Disease: AD
PCNDIDG0099
Glepidotin A
Canonical SMILES: CC(=CCC1=C2C(=C(C=C1O)O)C(=O)C(=C(O2)C3=CC=CC=C3)O)C
Class: Flavonoids
Disease: AD
PCNDIDG0100
Glepidotin B
Canonical SMILES: CC(=CCC1=C2C(=C(C=C1O)O)C(=O)C(C(O2)C3=CC=CC=C3)O)C
Class: Flavonoids
Disease: AD
PCNDIDG0101
Globeflowery acid
Canonical SMILES: CC1(CCC2=C(O1)C(=CC(=C2)C(=O)O)OC)C
Class: Benzopyrans
Disease: AD, PD
PCNDIDG0102
Glucosyringic acid
Canonical SMILES: COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C(=O)O
Class: Tannins
Disease: AD
PCNDIDG0103
Glutamic Acid
Canonical SMILES: C(CC(=O)O)C(C(=O)O)N
Class: Carboxylic acids and derivatives
Disease: AD
PCNDIDG0104
Glutamine
Canonical SMILES: C(CC(=O)N)C(C(=O)O)N
Class: Carboxylic acids and derivatives
Disease: AD
PCNDIDG0105
Glutamyl-Histidine
Canonical SMILES: C1=C(NC=N1)CC(C(=O)O)NC(=O)C(CCC(=O)O)N
Class: Carboxylic acids and derivatives
Disease: AD
PCNDIDG0106
Glutathione
Canonical SMILES: C(CC(=O)NC(CS)C(=O)NCC(=O)O)C(C(=O)O)N
Class: Carboxylic acids and derivatives
Disease: AD
PCNDIDG0107
Glyasperin B
Canonical SMILES: CC(=CCC1=C(C=C2C(=C1O)C(=O)C(CO2)C3=C(C=C(C=C3)O)O)OC)C
Class: Isoflavonoids
Disease: AD, PD
PCNDIDG0108
Glyasperin C
Canonical SMILES: CC(=CCC1=C(C2=C(C=C1O)OCC(C2)C3=C(C=C(C=C3)O)O)OC)C
Class: Isoflavonoids
Disease: AD, PD
PCNDIDG0109
Glyasperin F
Canonical SMILES: CC1(C=CC2=C(C=CC(=C2O1)C3COC4=CC(=CC(=C4C3=O)O)O)O)C
Class: Isoflavonoids
Disease: AD
PCNDIDG0110
Glyceollin
Canonical SMILES: CC1(C=CC2=C(O1)C=CC3=C2OCC4(C3OC5=C4C=CC(=C5)O)O)C
Class: Isoflavonoids
Disease: AD
PCNDIDG0111
Glycerin
Canonical SMILES: C(C(CO)O)O
Class: Organooxygen compounds
Disease: Epilepsy
PCNDIDG0112
Glycine
Canonical SMILES: C(C(=O)O)N
Class: Carboxylic acids and derivatives
Disease: PD, Canavan
PCNDIDG0113
Glycitein
Canonical SMILES: COC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)O)O
Class: Isoflavonoids
Disease: AD, PD
PCNDIDG0114
Glycitin
Canonical SMILES: COC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)O)OC4C(C(C(C(O4)CO)O)O)O
Class: Isoflavonoids
Disease: AD
PCNDIDG0115
Glycosminine
Canonical SMILES: C1=CC=C(C=C1)CC2=NC3=CC=CC=C3C(=O)N2
Class: Diazanaphthalenes
Disease: AD
PCNDIDG0116
Glycycoumarin
Canonical SMILES: CC(=CCC1=C(C2=C(C=C1O)OC(=O)C(=C2)C3=C(C=C(C=C3)O)O)OC)C
Class: Isoflavonoids
Disease: AD, PD, Huntington disease
PCNDIDG0117
Glycyrin
Canonical SMILES: CC(=CCC1=C(C=C2C(=C1OC)C=C(C(=O)O2)C3=C(C=C(C=C3)O)O)OC)C
Class: Isoflavonoids
Disease: AD
PCNDIDG0118
Glycyrol
Canonical SMILES: CC(=CCC1=C(C2=C(C=C1O)OC(=O)C3=C2OC4=C3C=CC(=C4)O)OC)C
Class: Isoflavonoids
Disease: AD
PCNDIDG0119
Glycyrrhetinic acid
Canonical SMILES: CC1(C2CCC3(C(C2(CCC1O)C)C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C
Class: Prenol lipids
Disease: AD, PD, Huntington disease
PCNDIDG0120
Glycyrrhisoflavone
Canonical SMILES: CC(=CCC1=C(C(=CC(=C1)C2=COC3=CC(=CC(=C3C2=O)O)O)O)O)C
Class: Isoflavonoids
Disease: PD
PCNDIDG0121
Glycyrrhiza flavonol A
Canonical SMILES: CC1(C(CC2=C(O1)C=CC(=C2)C3=C(C(=O)C4=C(C=C(C=C4O3)O)O)O)O)C
Class: Flavonoids
Disease: AD, PD
PCNDIDG0122
Glycyrrhizic acid
Canonical SMILES: CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C
Class: Prenol lipids
Disease: AD, PD, Meningitis, Myasthenia Gravis
PCNDIDG0123
Glycyrrhizic Acid Monoammonium Salt
Canonical SMILES: CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)[O-])O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C.[NH4+]
Class: Prenol lipids
Disease: AD
PCNDIDG0124
Glyoxylic acid
Canonical SMILES: C(=O)C(=O)O
Class: Carboxylic acids and derivatives
Disease: AD
PCNDIDG0125
Glyzaglabrin
Canonical SMILES: C1OC2=C(O1)C(=C(C=C2)C3=COC4=C(C3=O)C=CC(=C4)O)O
Class: Isoflavonoids
Disease: AD
PCNDIDG0126
Gnaphaliin
Canonical SMILES: COC1=C(C=C(C2=C1OC(=C(C2=O)OC)C3=CC=CC=C3)O)O
Class: Flavonoids
Disease: AD
PCNDIDG0127
Gnaphalin
Canonical SMILES: CC1CC(=O)C2(C(C13CC(OC3=O)C4=COC=C4)CCCC25CO5)CO
Class: Prenol lipids
Disease: PD, Epilepsy
PCNDIDG0128
Gomisin H
Canonical SMILES: CC1CC2=CC(=C(C(=C2C3=C(C(=C(C=C3CC1(C)O)OC)OC)OC)O)OC)OC
Class: Tannins
Disease: AD
PCNDIDG0129
Gomisin J
Canonical SMILES: CC1CC2=CC(=C(C(=C2C3=C(C(=C(C=C3CC1C)O)OC)OC)OC)OC)O
Class: Tannins
Disease: AD, PD
PCNDIDG0130
Gomisin K2, (+)-
Canonical SMILES: CC1CC2=CC(=C(C(=C2C3=C(C(=C(C=C3CC1C)OC)OC)OC)OC)OC)O
Class: Tannins
Disease: AD
PCNDIDG0131
Gomisin M2
Canonical SMILES: CC1CC2=CC3=C(C(=C2C4=C(C(=C(C=C4CC1C)OC)OC)OC)O)OCO3
Class: Tannins
Disease: AD, PD
PCNDIDG0132
gomisin N
Canonical SMILES: CC1CC2=CC3=C(C(=C2C4=C(C(=C(C=C4CC1C)OC)OC)OC)OC)OCO3
Class: Tannins
Disease: AD, PD
PCNDIDG0133
Gomisin O
Canonical SMILES: CC1CC2=CC3=C(C(=C2C4=C(C(=C(C=C4C(C1C)O)OC)OC)OC)OC)OCO3
Class: Tannins
Disease: AD
PCNDIDG0134
Gomisin S
Canonical SMILES: CC1CC2=CC(=C(C(=C2C3=C(C(=C(C=C3C(C1C)O)OC)OC)OC)OC)OC)O
Class: Tannins
Disease: AD
PCNDIDG0135
Gossypetin
Canonical SMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C(=C(C=C3O)O)O)O)O)O
Class: Flavonoids
Disease: AD, PD
PCNDIDG0136
Gossypetin 3,4'-dimethyl ether
Canonical SMILES: COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C(=C(C=C3O)O)O)OC)O
Class: Flavonoids
Disease: AD
PCNDIDG0137
Gossypetin 3-methyl ether
Canonical SMILES: COC1=C(OC2=C(C1=O)C(=CC(=C2O)O)O)C3=CC(=C(C=C3)O)O
Class: Flavonoids
Disease: AD
PCNDIDG0138
Gossypetin hexamethyl ether
Canonical SMILES: COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C(=C(C=C3OC)OC)OC)OC)OC
Class: Flavonoids
Disease: AD
PCNDIDG0139
Gossypin
Canonical SMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C(=C(C=C3O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O)O
Class: Flavonoids
Disease: AD
PCNDIDG0140
Gossypol
Canonical SMILES: CC1=CC2=C(C(=C(C(=C2C(C)C)O)O)C=O)C(=C1C3=C(C4=C(C=C3C)C(=C(C(=C4C=O)O)O)C(C)C)O)O
Class: Prenol lipids
Disease: AD, PD, Meningitis
PCNDIDG0141
Gramine
Canonical SMILES: CN(C)CC1=CNC2=CC=CC=C21
Class: Indoles and derivatives
Disease: AD, PD
PCNDIDG0142
Granatin A
Canonical SMILES: C1C2C3C(C(C(O2)C(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O1)O)O)O)O)O)O)OC(=O)C6=CC(=O)C7(C(C6C8=C(O7)C(=C(C=C8C(=O)O3)O)O)(O)O)O)O
Class: Tannins
Disease: AD
PCNDIDG0143
Grandidentatin
Canonical SMILES: C1CCC(C(C1)O)OC2C(C(C(C(O2)CO)O)O)OC(=O)C=CC3=CC=C(C=C3)O
Class: Cinnamic acids and derivatives
Disease: AD
PCNDIDG0144
Graveolinine
Canonical SMILES: COC1=CC(=NC2=CC=CC=C21)C3=CC4=C(C=C3)OCO4
Class: Quinolines and derivatives
Disease: Epilepsy
PCNDIDG0145
Grevillol
Canonical SMILES: CCCCCCCCCCCCCC1=CC(=CC(=C1)O)O
Class: Phenols
Disease: AD
PCNDIDG0146
Grifolin
Canonical SMILES: CC1=CC(=C(C(=C1)O)CC=C(C)CCC=C(C)CCC=C(C)C)O
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0147
Groenlandicine
Canonical SMILES: COC1=C(C=C2CC[N+]3=C(C2=C1)C=C4C=CC5=C(C4=C3)OCO5)O
Class: Protoberberine alkaloids and derivatives
Disease: AD
PCNDIDG0148
Guaiazulene
Canonical SMILES: CC1=C2C=CC(=C2C=C(C=C1)C(C)C)C
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0149
Guaiene
Canonical SMILES: CC1CCC(=C(C)C)CC2=C1CCC2C
Class: Prenol lipids
Disease: AD, PD
PCNDIDG0150
Guggulsterol II
Canonical SMILES: CC(C)CCCC(C)(C1C(CC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)O)O
Class: Steroids and steroid derivatives
Disease: AD, PD
PCNDIDG0151
Guggulsterol IV
Canonical SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(=O)C4(C3(CCC(=O)C4)C)O)C
Class: Steroids and steroid derivatives
Disease: AD
PCNDIDG0152
Guggulsterone
Canonical SMILES: CC=C1C(=O)CC2C1(CCC3C2CCC4=CC(=O)CCC34C)C
Class: Steroids and steroid derivatives
Disease: AD
PCNDIDG0153
Guineensine
Canonical SMILES: CC(C)CNC(=O)C=CC=CCCCCCCC=CC1=CC2=C(C=C1)OCO2
Class: Benzodioxoles
Disease: Epilepsy
PCNDIDG0154
Guvacine
Canonical SMILES: C1CNCC(=C1)C(=O)O
Class:
Disease: AD
PCNDIDG0155
Guvacoline
Canonical SMILES: COC(=O)C1=CCCNC1
Class:
Disease: AD