Bioactive Compound Details

BioIDbio98
NameGYROSANOLIDE C
ChEMBL IDCHEMBL1096138
Molecular FormulaC20H26O6
Molecular Weight362.42
Molecular Weight (Monoisotopic)362.1729
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsGyrosanolide C
SmilesC=C(C)[C@H]1C/C=C2/C(=O)O[C@H](C/C(C)=C/C(=O)[C@H](OC)CC(=O)C1)[C@H]2O
InchiInChI=1S/C20H26O6/c1-11(2)13-5-6-15-19(23)18(26-20(15)24)8-12(3)7-16(22)17(25-4)10-14(21)9-13/h6-7,13,17-19,23H,1,5,8-10H2,2-4H3/b12-7+,15-6-/t13-,17+,18+,19-/m0/s1
Inchi KeyWIWLIEUEOQQPHP-NOMAXEBQSA-N
Molecular SpeciesNEUTRAL
Targets10.0
Bioactivities11.0
Np Likeness Score2.42
Records Key['3']
Records Name['gyrosanolide C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure