Bioactive Compound Details

BioIDbio1430
NameTAIWANIN C
ChEMBL IDCHEMBL65755
Molecular FormulaC20H12O6
Molecular Weight348.31
Molecular Weight (Monoisotopic)348.0634
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsTaiwanin C
SmilesO=C1OCc2cc3cc4c(cc3c(-c3ccc5c(c3)OCO5)c21)OCO4
InchiInChI=1S/C20H12O6/c21-20-19-12(7-22-20)3-11-5-16-17(26-9-25-16)6-13(11)18(19)10-1-2-14-15(4-10)24-8-23-14/h1-6H,7-9H2
Inchi KeyYMGOOHXUOWZQOE-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets9.0
Bioactivities10.0
Np Likeness Score0.79
Records Key['11', '8']
Records Name[5-Benzo[1,3]dioxol-5-yl-8H-furo[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6-one", 'Taiwanin C']"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure