Bioactive Compound Details

BioIDbio1540
NameCRYPTOBEILIC ACID C
ChEMBL IDCHEMBL2334427
Molecular FormulaC22H20O5
Molecular Weight364.4
Molecular Weight (Monoisotopic)364.1311
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsCryptobeilic Acid C
SmilesO=C(O)C1=CC(=O)[C@@H]2C[C@H]3[C@H](Cc4ccc5c(c4)OCO5)[C@H]4C=C[C@@H]1[C@@H]2[C@H]43
InchiInChI=1S/C22H20O5/c23-17-8-15(22(24)25)12-3-2-11-13(14-7-16(17)21(12)20(11)14)5-10-1-4-18-19(6-10)27-9-26-18/h1-4,6,8,11-14,16,20-21H,5,7,9H2,(H,24,25)/t11-,12+,13-,14+,16+,20-,21+/m1/s1
Inchi KeyWIFSTHBLXUMVNG-OQBXOKOHSA-N
Molecular SpeciesACID
Targets6.0
Bioactivities6.0
Np Likeness Score2.1
Records Key['3']
Records Name['Cryptobeilic acid C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure