Bioactive Compound Details

BioIDbio941
NameZEDOALACTONE C
ChEMBL IDCHEMBL2386517
Molecular FormulaC15H22O4
Molecular Weight266.34
Molecular Weight (Monoisotopic)266.1518
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsNone
SmilesCC1=C2C[C@H]3[C@H](CC[C@]3(C)O)[C@@](C)(O)C[C@@H]2OC1=O
InchiInChI=1S/C15H22O4/c1-8-9-6-11-10(4-5-14(11,2)17)15(3,18)7-12(9)19-13(8)16/h10-12,17-18H,4-7H2,1-3H3/t10-,11-,12-,14-,15-/m0/s1
Inchi KeyBQDXDGDOYPUUOD-YLXLXVFQSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities5.0
Np Likeness Score2.85
Records Key['25', '12']
Records Name['Zedoalactone C', 'Zedoalactone C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure