Bioactive Compound Details

BioIDbio371
NameAXINYSONE C
ChEMBL IDCHEMBL461881
Molecular FormulaC15H22O3
Molecular Weight250.34
Molecular Weight (Monoisotopic)250.1569
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsAxinysone C
SmilesC[C@H]1CC[C@@H](OO)C2=CC(=O)[C@H]3[C@H](C3(C)C)[C@@]21C
InchiInChI=1S/C15H22O3/c1-8-5-6-11(18-17)9-7-10(16)12-13(14(12,2)3)15(8,9)4/h7-8,11-13,17H,5-6H2,1-4H3/t8-,11+,12-,13+,15+/m0/s1
Inchi KeyBMIGITXCSNEZHP-VCKDSHSUSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities3.0
Np Likeness Score3.71
Records Key['6']
Records Name['axinysone C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure