EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:43425 - METHYL(2-ACETOXY-2-(2-CARBOXY-4-AMINO-PHENYL))ACETATE

Default Structure
ChEBI IDCHEBI:43425
ChEBI NameMETHYL(2-ACETOXY-2-(2-CARBOXY-4-AMINO-PHENYL))ACETATE
Stars
DownloadsMolfile
FormulaC12H13NO6
Net Charge0
Average Mass267.237
Monoisotopic Mass267.07429
SMILES[H]OC(=O)c1c([H])c(N([H])[H])c([H])c([H])c1[C@@]([H])(OC(=O)C([H])([H])[H])C(=O)OC([H])([H])[H]
InChIInChI=1S/C12H13NO6/c1-6(14)19-10(12(17)18-2)8-4-3-7(13)5-9(8)11(15)16/h3-5,10H,13H2,1-2H3,(H,15,16)/t10-/m1/s1
InChIKeyDWYLZBJDRMVVPU-SNVBAGLBSA-N
ChEBI Ontology
Outgoing Relation(s)
METHYL(2-ACETOXY-2-(2-CARBOXY-4-AMINO-PHENYL))ACETATE (CHEBI:43425) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-[(1R)-1-(acetyloxy)-2-methoxy-2-oxoethyl]-5-aminobenzoic acidPDBeChem
METHYL(2-ACETOXY-2-(2-CARBOXY-4-AMINO-PHENYL))ACETATEPDBeChem
Manual XrefsDatabases
ICUPDBeChem