Bioactive Compound Details

BioIDbio329
NameFLAVALIN C
ChEMBL IDCHEMBL1689102
Molecular FormulaC16H24O3
Molecular Weight264.36
Molecular Weight (Monoisotopic)264.1725
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsFlavalin C
SmilesCO[C@H]1O[C@@]23C=CC[C@H](C)[C@@]2(C)[C@@H](C(=O)CC3)[C@@H]1C
InchiInChI=1S/C16H24O3/c1-10-6-5-8-16-9-7-12(17)13(15(10,16)3)11(2)14(18-4)19-16/h5,8,10-11,13-14H,6-7,9H2,1-4H3/t10-,11-,13+,14-,15-,16+/m0/s1
Inchi KeyFVTXNULUHYXYOE-HPYGTKAVSA-N
Molecular SpeciesNEUTRAL
Targets9.0
Bioactivities9.0
Np Likeness Score3.09
Records Key['3']
Records Name['Flavalin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure