Bioactive Compound Details

BioIDbio1233
NameUSTUSOL C
ChEMBL IDCHEMBL1080769
Molecular FormulaC16H28O4
Molecular Weight284.4
Molecular Weight (Monoisotopic)284.1988
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsUstusol C
SmilesCO[C@@H]1C=C(CO)[C@](O)(CO)[C@@]2(C)CCCC(C)(C)[C@H]12
InchiInChI=1S/C16H28O4/c1-14(2)6-5-7-15(3)13(14)12(20-4)8-11(9-17)16(15,19)10-18/h8,12-13,17-19H,5-7,9-10H2,1-4H3/t12-,13+,15+,16-/m1/s1
Inchi KeyZPHNAEGQIWXWGS-BFJAYTPKSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score3.22
Records Key['3, Ustusol C']
Records Name['6-O-methyl-12-hydroxy-6-epi-albrassitriol']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure