Bioactive Compound Details

BioIDbio717
NameTRICHOLOMALIDE C
ChEMBL IDCHEMBL444145
Molecular FormulaC20H28O5
Molecular Weight348.44
Molecular Weight (Monoisotopic)348.1937
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsTricholomalide C
SmilesC=C(CO)[C@]12C=C3C(=O)C[C@@H](C(C)C)[C@]3(C)C[C@@H](O)[C@@]1(C)CC(=O)O2
InchiInChI=1S/C20H28O5/c1-11(2)13-6-15(22)14-7-20(12(3)10-21)19(5,9-17(24)25-20)16(23)8-18(13,14)4/h7,11,13,16,21,23H,3,6,8-10H2,1-2,4-5H3/t13-,16+,18-,19+,20+/m0/s1
Inchi KeyLAUXGJSHPLNZHD-LVQIXTDASA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score3.03
Records Key['3']
Records Name['Tricholomalide C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure