Bioactive Compound Details

BioIDbio1801
NameALSTILOBANINE C
ChEMBL IDCHEMBL462125
Molecular FormulaC19H22N2O3
Molecular Weight326.4
Molecular Weight (Monoisotopic)326.163
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsAlstilobanine C
SmilesCOC(=O)[C@@]12COCC[C@@H]3[C@@H](NCC[C@@H]31)c1c2[nH]c2ccccc12
InchiInChI=1S/C19H22N2O3/c1-23-18(22)19-10-24-9-7-11-13(19)6-8-20-16(11)15-12-4-2-3-5-14(12)21-17(15)19/h2-5,11,13,16,20-21H,6-10H2,1H3/t11-,13-,16+,19-/m0/s1
Inchi KeyDJGCISNEPWGNJS-IKTQFDNCSA-N
Molecular SpeciesBASE
Targets1.0
Bioactivities1.0
Np Likeness Score0.95
Records Key['3']
Records Name['Alstilobanine C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure