Bioactive Compound Details

BioIDbio1672
NameNone
ChEMBL IDCHEMBL260632
Molecular FormulaC28H24O3
Molecular Weight408.5
Molecular Weight (Monoisotopic)408.1725
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonyms12-Dehydroxyriccardin C
SmilesOc1ccc2c(c1)CCc1ccc(cc1)Oc1cc(ccc1O)CCc1ccc-2cc1
InchiInChI=1S/C28H24O3/c29-24-12-15-26-22-9-3-19(4-10-22)1-2-21-8-16-27(30)28(17-21)31-25-13-6-20(7-14-25)5-11-23(26)18-24/h3-4,6-10,12-18,29-30H,1-2,5,11H2
Inchi KeyVSXIMYQGZUVRSK-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities6.0
Np Likeness Score1.7
Records Key['30', '20c']
Records Name['14-oxapentacyclo[20.2.2.2^{10,13}.1^{15,19}.0^{2,7}]nonacosa-1(24),2,4,6,10,12,15(27),16,18,22,25,28-dodecaene-5,16-diol', '12-dehydroxyriccardin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure