| Phytochemical Name : Ellagic Acid |
| PCNDIDE0015 |
| Pubchem CID : 5281855 |
| Molecular formula: C14H6O8 |
| Canonical SMILES : C1=C2C3=C(C(=C1O)O)OC(=O)C4=CC(=C(C(=C43)OC2=O)O)O |
Synonymes : ellagic acid|476-66-4|Benzoaric acid|Elagostasine|Lagistase|Eleagic acid|Alizarine Yellow|2,3,7,8-Tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione|Gallogen|Llagic acid|Acido elagico|Acidum ellagicum|Ellagicacid|Acide ellagique|Gallogen (astringent)|C.I. 55005|C.I. 75270|Gallogen (VAN)|CCRIS 774|Ellagsaeure|Ellagate|C14H6O8|Pomegranate juice|Ellagic acid [INN:DCF]|UNII-19YRN3ZS9P|EINECS 207-508-3|19YRN3ZS9P|NSC407286|Acido elagico [INN-Spanish]|Gallogen, astringent|NSC 407286|NSC 656272|NSC-407286|NSC-656272|Acide ellagique [INN-French]|Acidum ellagicum [INN-Latin]|BRN 0047549|CHEBI:4775|MLS000069632|DTXSID2020557|HSDB 7574|NSC656272|4,4',5,5',6,6'-hexahydroxydiphenic acid 2,6,2',6'-dilactone|CHEMBL6246|2,3,7,8-Tetrahydroxy(1)benzopyrano(5,4,3-cde)(1)benzopyran-5,10-dione|SMR000058244|DTXCID60557|Diphenic acid, 4,4',5,5',6,6'-hexahydroxy-, di-delta-lactone|5-19-07-00108 (Beilstein Handbook Reference)|(1)Benzopyrano(5,4,3-cde)(1)benzopyran-5,10-dione, 2,3,7,8-tetrahydroxy-|2,3,7,8-Tetrahydroxy(1)benzopyrano(5,4,3-cde)-(1)benzopyran-5,10-dione|tetrahydroxy[?]dione|NCGC00017245-02|Ellagic acid hydrate|6,7,13,14-tetrahydroxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione|Acide ellagique (INN-French)|Acid, Benzoaric|[1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 2,3,7,8-tetrahydroxy-|2,3,7,8-tetrahydroxy[1]benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione|Acid, Ellagic|CAS-476-66-4|SR-01000721925|MFCD00006914|Benzoarate|Eleagate|Ellagic|Llagate|2,3,7,8-tetrahydroxychromeno(5,4,3-cde)chromene-5,10-dione|ellagic-acid|Elleagic acid|Elagic Acid|2,3,7,8-Tetrahydroxy(1)-benzopyrano(5,4,3-cde)(1)benzopyran-5,10-dione|2,3,7,8-Tetrahydroxy[1]-benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione|2zjw|REF|Ellagic acid, 96%|Spectrum_001194|Spectrum2_000905|Spectrum3_001535|Spectrum4_000750|Spectrum5_000959|Ellagic acid [DCF:INN]|D0A1CM|ELLAGIC ACID [MI]|ELLAGIC ACID [INN]|ELLAGIC ACID [HSDB]|ELLAGIC ACID [INCI]|Oprea1_032884|SCHEMBL20429|BSPBio_002950|KBioGR_001080|KBioSS_001674|MLS006011868|BIDD:ER0482|BIDD:GT0565|SPECTRUM1502245|SPBio_000750|ELLAGIC ACID [WHO-DD]|BDBM4078|LTK-20|SCHEMBL19184504|BCBcMAP01_000154|cid_5281855|KBio2_001674|KBio2_004242|KBio2_006810|KBio3_002450|Ellagic acid, analytical standard|HMS1921N20|HMS3673M09|Pharmakon1600-01502245|BCP10830|HY-B0183|TNP00132|Tox21_110805|BBL009292|C14-H6-O8|CCG-36358|NSC758198|s1327|STK801964|Ellagic acid, >=96.0% (HPCE)|AKOS004120045|Tox21_110805_1|CS-2067|DB08846|LS-1285|NSC-758198|SDCCGMLS-0066664.P001|SMP1_000111|NCGC00017245-01|NCGC00017245-03|NCGC00017245-04|NCGC00017245-05|NCGC00017245-06|NCGC00017245-07|NCGC00017245-08|NCGC00017245-09|NCGC00017245-10|NCGC00017245-12|NCGC00094975-01|NCGC00094975-02|NCGC00094975-03|NCGC00094975-04|NCGC00178375-01|AC-11647|AC-30710|AS-35095|CI 55005|CI 75270|NCI60_003869|SBI-0051742.P002|E0375|Ellagic Acid, Dihydrate - CAS 476-66-4|FT-0603405|MLS-0066664.0001|AB00052292_11|AB00052292_12|EN300-6472707|A872094|Q422044|SR-01000721925-3|SR-01000721925-4|SR-01000721925-5|SR-01000721925-6|SR-01000721925-7|W-202834|BRD-K30466858-001-05-4|Ellagic acid, primary pharmaceutical reference standard|Diphenic acid,4',5,5',6,6'-hexahydroxy-, di-.delta.-lactone|2,3,7,8-Tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione #|4,4',5,5',6,6'-Hexahydrodiphenic acid 2,6,2',6'-dilactone|Diphenic acid, 4,4',5,5',6,6'-hexahydroxy-, di-.delta.-lactone|[1]Benzopyrano[5,3-cde][1]benzopyran-5,10-dione, 2,3,7,8-tetrahydroxy-|2,3,7,8-Tetrahydroxy(1)benzopyrano(5,4,3-cde)(1)-benzopyran-5,10-dione|2,3,7,8-Tetrahydroxy-[1]benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione|2,3,7,8-TETRAHYDROXY-CHROMENO[5,4,3-CDE]CHROMENE-5,10-DIONE|2,3,7,8-Tetrahydroxy[1]benzopyrano-[5,4,3-cde][1]benzopyran-5,10-dione|(1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',5,5',6,6'-hexahydroxy-, di-delta-lactone|[1,2'-dicarboxylic acid, 4,4',5,5',6,6'-hexahydroxy-, di-.delta.-lactone|(1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',5,5',6,6'-hexahydroxy-, di-.delta.-lactone|122328-15-8|6,7,13,14-tetrahydroxy-2,9-dioxatetracyclo[6.6.2.0^{4,16}.0^{11,15}]hexadeca-1(14),4(16),5,7,11(15),12-hexaene-3,10-dione|6,7,13,14-tetrahydroxy-2,9-dioxatetracyclo[6.6.2.0^{4,16}.0^{11,15}]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione|6,7,13,14-tetrahydroxy-2,9-dioxatetracyclo[6.6.2.0^{4,16}.0^{11,15}]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione |
| Structure | |
| 3D structure | 2D structure |
![]() |
| Log Po/w (iLOGP) : 0.790 |
| Log Po/w (XLOGP3) : 1.100 |
| Log Po/w (WLOGP) : 1.310 |
| Log Po/w (MLOGP) : 0.140 |
| Log Po/w (SILICOS-IT) : 1.670 |
| Consensus Log Po/w : 1.000 |

