Bioactive Compound Details

BioIDbio876
NameARISANTETRALONE C
ChEMBL IDCHEMBL1080420
Molecular FormulaC21H24O5
Molecular Weight356.42
Molecular Weight (Monoisotopic)356.1624
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsArisantetralone C
SmilesCOc1cc2c(cc1O)C(=O)[C@@H](C)[C@@H](C)[C@@H]2c1ccc(OC)c(OC)c1
InchiInChI=1S/C21H24O5/c1-11-12(2)21(23)15-9-16(22)18(25-4)10-14(15)20(11)13-6-7-17(24-3)19(8-13)26-5/h6-12,20,22H,1-5H3/t11-,12+,20-/m1/s1
Inchi KeyDRKPZVVNEGETTG-XAAFQQQXSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities3.0
Np Likeness Score1.27
Records Key['3']
Records Name['Arisantetralone C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure