Bioactive Compound Details

BioIDbio524
NameGEOPYXIN C
ChEMBL IDCHEMBL2022259
Molecular FormulaC20H26O5
Molecular Weight346.42
Molecular Weight (Monoisotopic)346.178
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsGeopyxin C
SmilesC=C1C(=O)[C@]23C[C@H]1CC[C@H]2[C@]1(C)C(=O)CC[C@@](C)(C(=O)O)[C@H]1C[C@@H]3O
InchiInChI=1S/C20H26O5/c1-10-11-4-5-12-19(3)13(8-15(22)20(12,9-11)16(10)23)18(2,17(24)25)7-6-14(19)21/h11-13,15,22H,1,4-9H2,2-3H3,(H,24,25)/t11-,12+,13-,15+,18-,19+,20-/m1/s1
Inchi KeyCLGOGJHVMHIUDO-VRHUIZLCSA-N
Molecular SpeciesACID
Targets5.0
Bioactivities5.0
Np Likeness Score3.37
Records Key['3, Geopyxin C']
Records Name['(7S)-7-hydroxy-1,15-dioxo-ent-kaur-16-en-19-oic acid']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure