Bioactive Compound Details

BioIDbio1161
NameCALLYTRIOL C
ChEMBL IDCHEMBL464960
Molecular FormulaC23H24O3
Molecular Weight348.44
Molecular Weight (Monoisotopic)348.1725
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsCallytriol C
SmilesC#C/C=C\C(O)CCC/C=C\C#CC#CCCCC#CC#CC(O)CO
InchiInChI=1S/C23H24O3/c1-2-3-18-22(25)19-16-14-12-10-8-6-4-5-7-9-11-13-15-17-20-23(26)21-24/h1,3,10,12,18,22-26H,7,9,11,14,16,19,21H2/b12-10-,18-3-
Inchi KeyMCGQEEDLOVPSRE-WUYTVGJRSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score3.13
Records Key['6']
Records Name['callytriol C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure