Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0MF5Y
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| Former ID |
DNC003270
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| Drug Name |
3,7,3',4'-TETRAHYDROXYFLAVONE
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| Synonyms |
Fisetin; 528-48-3; 2-(3,4-Dihydroxyphenyl)-3,7-dihydroxy-4H-chromen-4-one; 5-Desoxyquercetin; Fustel; Cotinin; Viset; 3,3',4',7-Tetrahydroxyflavone; Fisetholz; Superfustel; Fustet; Fietin; Junger fustik; 3,7,3',4'-Tetrahydroxyflavone; Ventin sumach; Zante fustic; Young fustic; Superfustel K; Ungarisches gelbholz; CI Natural Brown 1; Young fustic crystals; Bois bleu de Honqrie; BOIS bleude honqrie; CI 75620; NSC 407010; NSC 656275; 5-Deoxyquercetin; 2-(3,4-Dihydroxyphenyl)-3,7-dihydroxy-4H-1-benzopyran-4-one; Natural Brown 1; FISETIN
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1], [2] | |
| Structure |
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Download2D MOL |
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| Formula |
C15H10O6
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| Canonical SMILES |
C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O)O)O
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| InChI |
1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-18,20H
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| InChIKey |
XHEFDIBZLJXQHF-UHFFFAOYSA-N
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| CAS Number |
CAS 528-48-3
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| PubChem Compound ID | ||||
| PubChem Substance ID |
12227, 476876, 507096, 598776, 854619, 877431, 3133267, 7584531, 7887589, 8137407, 8616674, 10318997, 11108248, 11113262, 11113263, 11341731, 11361914, 11364090, 11366652, 11369214, 11372551, 11374538, 11377376, 11408257, 11446655, 11484855, 11487316, 11488976, 11491351, 11492884, 11495010, 11537677, 12015309, 14922300, 22389243, 26612353, 26680015, 26697264, 26749675, 26753766, 29204137, 39290396, 46393572, 47960466, 48035861, 48421823, 49833373, 49970085, 50123013, 52761154
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| ChEBI ID |
CHEBI:42567
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| References | Top | |||
|---|---|---|---|---|
| REF 1 | The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. | |||
| REF 2 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5182). | |||
| REF 3 | Crystal structure of a human cyclin-dependent kinase 6 complex with a flavonol inhibitor, fisetin. J Med Chem. 2005 Feb 10;48(3):737-43. | |||
| REF 4 | Inhibition of Plasmodium falciparum fatty acid biosynthesis: evaluation of FabG, FabZ, and FabI as drug targets for flavonoids. J Med Chem. 2006 Jun 1;49(11):3345-53. | |||
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