Bioactive Compound Details

BioIDbio1647
NameHEYNEANONES C
ChEMBL IDCHEMBL2332439
Molecular FormulaC15H24O4
Molecular Weight268.35
Molecular Weight (Monoisotopic)268.1675
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsHeyneanones C
SmilesCC(C)=C1C[C@@H](O)[C@@](C)(O)CC[C@@H](O)/C(C)=C\C1=O
InchiInChI=1S/C15H24O4/c1-9(2)11-8-14(18)15(4,19)6-5-12(16)10(3)7-13(11)17/h7,12,14,16,18-19H,5-6,8H2,1-4H3/b10-7-/t12-,14-,15+/m1/s1
Inchi KeyAGMVUQMPIYDZOG-HOHRPOLTSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities4.0
Np Likeness Score2.92
Records Key['3, Heyneanones C']
Records Name['1alpha,4beta,5beta-Trihydroxy-7(11),9-germacradien-8-one']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure