Bioactive Compound Details

BioIDbio741
NameNECTAMAZIN C
ChEMBL IDCHEMBL570290
Molecular FormulaC23H32O7
Molecular Weight420.5
Molecular Weight (Monoisotopic)420.2148
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsNectamazin C
SmilesC=CCC1=C[C@@]2(OC)[C@@H](C)[C@H](c3cc(OC)c(OC)c(OC)c3)[C@](OC)([C@H]1O)[C@H]2O
InchiInChI=1S/C23H32O7/c1-8-9-14-12-22(29-6)13(2)18(23(30-7,20(14)24)21(22)25)15-10-16(26-3)19(28-5)17(11-15)27-4/h8,10-13,18,20-21,24-25H,1,9H2,2-7H3/t13-,18+,20-,21-,22+,23-/m0/s1
Inchi KeyOHVTXDBRSOSKKO-BHIPVSGSSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities7.0
Np Likeness Score1.73
Records Key['10']
Records Name['Nectamazin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure