Bioactive Compound Details

BioIDbio1782
NameARENARIN C
ChEMBL IDCHEMBL472014
Molecular FormulaC30H30O7
Molecular Weight502.56
Molecular Weight (Monoisotopic)502.1992
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsArenarin C
SmilesC=C(C)C1Cc2c(ccc(OC)c2OC/C=C(\C)CO)C2=C1C(=O)C(c1ccc(O)cc1)=C(OC)C2=O
InchiInChI=1S/C30H30O7/c1-16(2)21-14-22-20(10-11-23(35-4)29(22)37-13-12-17(3)15-31)25-26(21)27(33)24(30(36-5)28(25)34)18-6-8-19(32)9-7-18/h6-12,21,31-32H,1,13-15H2,2-5H3/b17-12+
Inchi KeyBQLWDRCEVNYDMK-SFQUDFHCSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score1.86
Records Key['3']
Records Name['arenarin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure