PDND
Phytochemical Database for Neurological Disorders
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Phytochemical Name : Imperatorin
PCNDIDI0011
Pubchem CID : 10212
Molecular formula: C16H14O4

Molecular weight : 270.280

Canonical SMILES : CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C

Synonymes : IMPERATORIN|482-44-0|Ammidin|Marmelosin|Pentosalen|8-Isoamylenoxypsoralen|8-Isopentenyloxypsoralene|Marmelide|NSC 402949|9-(3-methylbut-2-enoxy)furo[3,2-g]chromen-7-one|CCRIS 4346|HSDB 3497|9-(3-Methylbut-2-enyloxy)furo(3,2-g)chromen-7-one|EINECS 207-581-1|7H-Furo[3,2-g][1]benzopyran-7-one, 9-[(3-methyl-2-butenyl)oxy]-|Pentosalen [BAN]|NSC-402949|CHEBI:5885|DTXSID8048737|UNII-K713N25C78|AI3-61725|K713N25C78|9-((3-Methyl-2-butenyl)oxy)-7H-furo(3,2-g)(1)benzopyran-7-one|CHEMBL453805|DTXCID5028663|9-[(3-methyl-2-buten-1-yl)oxy]-7H-furo[3,2-g]chromen-7-one|9-[(3-methylbut-2-en-1-yl)oxy]-7H-furo[3,2-g]chromen-7-one|7H-Furo(3,2-g)(1)benzopyran-7-one, 9-((3-methyl-2-butenyl)oxy)-|5-Benzofuranacrylic acid, 6-hydroxy-7-((3-methyl-2-butenyl)oxy)-, delta-lactone|6-Hydroxy-7-(3-methyl-2-butenyloxy)-5-benzofuranacrylic acid omega-lactone|9-[(3-METHYL-2-BUTEN-1-YL)OXY]-7H-FURO[3,2-G][1]BENZOPYRAN-7-ONE|MFCD00016881|9-(3-Methylbut-2-enyloxy)furo[3,2-g]chromen-7-one|9-(3-Methylbut-2-enyloxy)-7H-furo(3,2-g)chromen-7-one|NCGC00095209-01|9-((3-methylbut-2-en-1-yl)oxy)-7H-furo[3,2-g]chromen-7-one|MARMELOSIN (USP-RS)|MARMELOSIN [USP-RS]|9-(3-methylbut-2-enyloxy)-7H-furo[3,2-g]chromen-7-one|9-[(3-methyl-2-butenyl)oxy]-7H-furo[3,2-g]-1-benzopyran-7-one|CAS-482-44-0|9-((3-methyl-2-butenyl)oxy)-7H-furo(3,2-g)-1-benzopyran-7-one|9-((3-methylbut-2-en-1-yl)oxy)-7H-furo(3,2-g)chromen-7-one|7H-Furo[3,2-g][1]benzopyran-7-one, 9-((3-methyl-2-butenyl)oxy)-|Pentasalen, BAN|Imperatorin,(S)|8-Prenyloxypsoralen|Spectrum_000755|SpecPlus_000755|IMPERATORIN [MI]|Spectrum2_000376|Spectrum3_000145|Spectrum4_001422|Spectrum5_000244|PENTOSALEN [HSDB]|[3,2-g]chromen-7-one|D09ROW|PENTOSALEN [WHO-DD]|Oprea1_407817|SCHEMBL50437|BSPBio_001850|KBioGR_001864|KBioSS_001235|SPECTRUM102076|MLS000574838|DivK1c_006851|SPBio_000531|Marmelosin, analytical standard|MEGxp0_000089|ACon1_001117|KBio1_001795|KBio2_001235|KBio2_003803|KBio2_006371|KBio3_001050|HMS1922N22|HMS2218G08|HMS3261C08|HMS3354E04|HMS3885G06|BCP28280|HY-N0285|8-(3-Methyl-2-butenyloxy)psoralen|Tox21_113179|Tox21_500413|BDBM50308719|CCG-38649|NSC402949|s3809|9-(3-methylbut-2-enyloxy)-7H-furo|AKOS000277029|Tox21_113179_1|AC-8046|CS-5800|Imperatorin, >=98% (HPLC), powder|LP00413|SDCCGMLS-0066373.P001|SDCCGSBI-0052715.P002|NCGC00095209-02|NCGC00095209-03|NCGC00095209-04|NCGC00095209-05|NCGC00095209-06|NCGC00095209-12|NCGC00169661-01|NCGC00169661-02|NCGC00261098-01|AS-71539|LS-70737|SMR000156241|WLN: T C566 DO LVOTJ BO2UY1&1|FT-0603414|I0904|7H-Furo[3, 9-[(3-methyl-2-butenyl)oxy]-|A14565|C09269|A827504|SR-01000721772|Q-100532|Q1649534|SR-01000721772-2|9-(3-Methyl-2-butenyloxy)-7-oxofuro[3,2-g]chromene|9-(3-Methyl-but-2-enyloxy)-furo[3,2-g]chromen-7-one|Imperatorin, European Pharmacopoeia (EP) Reference Standard|9-(3-methylbut-2-enoxy)furo[3,2-g]chromen-7-one;Imperatorin|9-[(3-Methyl-2-butenyl)oxy]-7H-furo[3,2-g]chromen-7-one #|9-[(3-methylbut-2-en-1-yl)oxy]-2H-furo[3,2-g]chromen-2-one|9-[(3-Methylbut-2-enyl)oxy]-7H-furo[3,2-g][1]benzopyran-7-one|(9-[(3-methyl-2-buten-1-yl)oxy]-7H-furo[3,2-g][1]benzopyran-7-one)|6-hydroxy-7-(3-methyl-2-butenyloxy)-5-benzofuranacrylic acid delta-lactone|6-Hydroxy-7-(3-Methyl-2-Butenyloxy)-5-Benzofuranacrylic Acid Gamma-Lactone|6-Hydroxy-7-(3-methyl-2butenyloxy)-5-benzofuranacrylic acid delta-lactone|7H-Furo[3,2-g][1]benzopyran-7-one, 9-[(3-methyl-2-buten-1-yl)oxy]-|9-[(3-Methyl-2-butenyl)oxy]-7H-furo[3,2-g][1]benzopyran-7-one, 9CI|5-Benzofuranacrylic acid, 6-hydroxy-7-((3-methyl-2-butenyl)oxy)-, .delta.-lactone|6-HYDROXY-7-(3-METHYL-2-BUTENYLOXY)-5-BENZOFURANACRYLIC ACID .GAMMA.-LACTONE

Structure
3D structure 2D structure
10212
Predicted properties (NCBI Pubchem)

Physicochemical Properties