Bioactive Compound Details

BioIDbio199983
NameNone
ChEMBL IDCHEMBL1161935
Molecular FormulaC12H13NO6
Molecular Weight267.24
Molecular Weight (Monoisotopic)267.0743
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-(Benzyloxycarbonyl)Succinate
SmilesO=C(O)CC(NC(=O)OCc1ccccc1)C(=O)O
InchiInChI=1S/C12H13NO6/c14-10(15)6-9(11(16)17)13-12(18)19-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,18)(H,14,15)(H,16,17)
Inchi KeyXYXYXSKSTZAEJW-UHFFFAOYSA-N
Molecular SpeciesACID
Targets1.0
Bioactivities2.0
Np Likeness Score-0.08
Records Key['1']
Records Name['2-(benzyloxycarbonyl)succinate']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure