Bioactive Compound Details

BioIDbio209
NameANCISTROCONGOLINE C
ChEMBL IDCHEMBL489958
Molecular FormulaC26H31NO4
Molecular Weight421.54
Molecular Weight (Monoisotopic)421.2253
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsAncistrocongoline C
SmilesCOc1cc(O)c(-c2ccc(OC)c3c(OC)cc(C)cc23)c2c1[C@@H](C)N(C)[C@H](C)C2
InchiInChI=1S/C26H31NO4/c1-14-10-18-17(8-9-21(29-5)26(18)22(11-14)30-6)25-19-12-15(2)27(4)16(3)24(19)23(31-7)13-20(25)28/h8-11,13,15-16,28H,12H2,1-7H3/t15-,16-/m1/s1
Inchi KeyRNLKCMIGQLHEKX-HZPDHXFCSA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities5.0
Np Likeness Score1.48
Records Key['6']
Records Name['ancistrocongoline C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure