Bioactive Compound Details

BioIDbio567
NameSCUTIANTHRAQUINONE C
ChEMBL IDCHEMBL451608
Molecular FormulaC34H24O12
Molecular Weight624.55
Molecular Weight (Monoisotopic)624.1268
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsScutianthraquinone C
SmilesCOC(=O)c1c(O)cc2c(c1C)C(=O)c1c(ccc(C3(O)c4cccc(O)c4C(=O)c4c3cc(O)c(C(=O)OC)c4C)c1O)C2=O
InchiInChI=1S/C34H24O12/c1-12-22-15(10-20(36)24(12)32(42)45-3)28(38)14-8-9-17(29(39)26(14)30(22)40)34(44)16-6-5-7-19(35)27(16)31(41)23-13(2)25(33(43)46-4)21(37)11-18(23)34/h5-11,35-37,39,44H,1-4H3
Inchi KeyJFUFATWECSQGDK-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities5.0
Np Likeness Score1.22
Records Key['3']
Records Name['scutianthraquinone C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure