Bioactive Compound Details

BioIDbio952
NameTENELLIC ACID C
ChEMBL IDCHEMBL452487
Molecular FormulaC23H26O8
Molecular Weight430.45
Molecular Weight (Monoisotopic)430.1628
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsTenellic acid C
SmilesCOc1c(C(CC(C)C)OC(C)=O)ccc(Oc2c(O)cc(C)cc2C=O)c1C(=O)O
InchiInChI=1S/C23H26O8/c1-12(2)8-19(30-14(4)25)16-6-7-18(20(23(27)28)22(16)29-5)31-21-15(11-24)9-13(3)10-17(21)26/h6-7,9-12,19,26H,8H2,1-5H3,(H,27,28)
Inchi KeyIGGGJHYOBPGVLF-UHFFFAOYSA-N
Molecular SpeciesACID
Targets3.0
Bioactivities3.0
Np Likeness Score1.14
Records Key['3']
Records Name['Tenellic acid C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure