Bioactive Compound Details

BioIDbio419
NameLAEVINOL C
ChEMBL IDCHEMBL463355
Molecular FormulaC14H22O3
Molecular Weight238.33
Molecular Weight (Monoisotopic)238.1569
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonymslaevinol C
SmilesCC(=O)[C@H]1[C@H](O)CCC2=C[C@@H](O)C[C@H](C)[C@]21C
InchiInChI=1S/C14H22O3/c1-8-6-11(16)7-10-4-5-12(17)13(9(2)15)14(8,10)3/h7-8,11-13,16-17H,4-6H2,1-3H3/t8-,11-,12+,13-,14+/m0/s1
Inchi KeyUCBOCFFXBGGPKI-WBKHQIRZSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score2.87
Records Key['3, laevinol C']
Records Name['6alpha-acetyl-4beta,5beta-dimethyl-1(10)-ene-2alpha,7beta-dihydroxydecalin']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure