Bioactive Compound Details

BioIDbio1736
NamePSEUDOCARDATOLIDE C
ChEMBL IDCHEMBL507953
Molecular FormulaC20H22O5
Molecular Weight342.39
Molecular Weight (Monoisotopic)342.1467
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsPseudocardatolide C
SmilesCc1cc(=O)oc2c3c(c4c(c12)O[C@@H](C)[C@@H](C)[C@H]4O)OC(C)(C)C=C3
InchiInChI=1S/C20H22O5/c1-9-8-13(21)24-17-12-6-7-20(4,5)25-18(12)15-16(22)10(2)11(3)23-19(15)14(9)17/h6-8,10-11,16,22H,1-5H3/t10-,11+,16-/m1/s1
Inchi KeyAAPFBQWCKBJQGL-OHUAYANFSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score2.52
Records Key['6']
Records Name['pseudocardatolide C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure