Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004133
Inhibitor ClassHomo-isoflavonoids
Molecule Name in Refrence ArticleEPIHEMATOXYLOL
IUPAC Name(3R,4R)-3-[(3,4-dihydroxyphenyl)methyl]-3,4-dihydro-2H-1-benzopyran-3,4,7,8-tetrol
FormulaC16H16O7
Mass320.294
Exact Mass320.0896029
Composition C (60%), H (5.04%), O (34.97%)
Atom Count39
PI2.84
Smilesc12c(c(ccc1[C@H]([C@](CO2)(Cc1ccc(c(c1)O)O)O)O)O)O
InChI1S/C16H16O7/c17-10-3-1-8(5-12(10)19)6-16(22)7-23-14-9(15(16)21)2-4-11(18)13(14)20/h1-5,15,17-22H,6-7
H2/t15-,16-/m1/s1
InChIKeyFUVGPYLFLOWRMC-HZPDHXFCSA-N
2D Structure
Structure Backbone
View Structure in JmolClick to view 3 d structure                            Download Mol File
Drug Like PropertyDruglikeliness
Symmetry & GeometrySymmetry And Geometrical Information
Activity & Binding Activity against isoform and covalant binding information
Topological PropertiesDescriptors
Reference18610999
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesFGFR2 | c-Src | c-kit | KDR | c-Met | FGFR1 | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link 24698425
ChEMBL Link CHEMBL478611
 
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