Bioactive Compound Details

BioIDbio198557
Name2-METHYL DESMOSDUMOTIN B
ChEMBL IDCHEMBL527052
Molecular FormulaC19H18O4
Molecular Weight310.35
Molecular Weight (Monoisotopic)310.1205
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsNone
SmilesCC1=C(O)c2c(oc(-c3ccccc3C)cc2=O)C(C)(C)C1=O
InchiInChI=1S/C19H18O4/c1-10-7-5-6-8-12(10)14-9-13(20)15-16(21)11(2)17(22)19(3,4)18(15)23-14/h5-9,21H,1-4H3
Inchi KeyJXZAPJKDKZPIEA-UHFFFAOYSA-N
Molecular SpeciesACID
Targets3.0
Bioactivities3.0
Np Likeness Score0.98
Records Key['4']
Records Name['2-Methyl desmosdumotin B']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure