Bioactive Compound Details

BioIDbio113
NameSCHISANDRIN C
ChEMBL IDCHEMBL437412
Molecular FormulaC22H24O6
Molecular Weight384.43
Molecular Weight (Monoisotopic)384.1573
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsSchisandrin C|Wuweizisu C
SmilesCOc1c2c(cc3c1-c1c(cc4c(c1OC)OCO4)C[C@H](C)[C@H](C)C3)OCO2
InchiInChI=1S/C22H24O6/c1-11-5-13-7-15-19(27-9-25-15)21(23-3)17(13)18-14(6-12(11)2)8-16-20(22(18)24-4)28-10-26-16/h7-8,11-12H,5-6,9-10H2,1-4H3/t11-,12+
Inchi KeyHTBWBWWADZJXID-TXEJJXNPSA-N
Molecular SpeciesNEUTRAL
Targets24.0
Bioactivities32.0
Np Likeness Score1.12
Records Key['Wuweizisu C', '90', '40', '9', '8', '9', '7', '26', '3']
Records Name['wuweizisu C', 'schisandrin C', 'schisandrin C', 'Schisandrin C', 'schisandrin C', 'wuweizisu C', 'NA', 'Schisandrin C', 'Wuweizisu C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure