Bioactive Compound Details

BioIDbio734
NameVIRESCENOSIDE C
ChEMBL IDCHEMBL502798
Molecular FormulaC31H50O7
Molecular Weight534.73
Molecular Weight (Monoisotopic)534.3557
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonymsvirescenoside C
SmilesC=C[C@@]1(C)CC[C@H]2C(=CCC3[C@@](C)(CO[C@]4(C)O[C@](C)(CO)[C@@](C)(O)[C@](C)(O)[C@]4(C)O)C(=O)CC[C@@]32C)C1
InchiInChI=1S/C31H50O7/c1-10-24(2)15-13-21-20(17-24)11-12-22-25(21,3)16-14-23(33)26(22,4)19-37-31(9)30(8,36)29(7,35)28(6,34)27(5,18-32)38-31/h10-11,21-22,32,34-36H,1,12-19H2,2-9H3/t21-,22?,24-,25+,26+,27+,28+,29-,30-,31+/m0/s1
Inchi KeyCFBPITAYEOHZQZ-FTNKJTTASA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score2.52
Records Key['5, virescenoside C']
Records Name['beta-D-altropyranosido-19-3-oxo-isopimara-7,15-diene']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure