Chemical Component Summary

NameMETHYL(2-ACETOXY-2-(2-CARBOXY-4-AMINO-PHENYL))ACETATE
Identifiers2-[(1R)-1-acetyloxy-2-methoxy-2-oxo-ethyl]-5-amino-benzoic acid
FormulaC12 H13 N O6
Molecular Weight267.235
TypeNON-POLYMER
Isomeric SMILESCC(=O)O[C@H](c1ccc(cc1C(=O)O)N)C(=O)OC
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

Chemical Details

Formal Charge0
Atom Count32
Chiral Atom Count1
Bond Count32
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB07957 
NameMETHYL(2-ACETOXY-2-(2-CARBOXY-4-AMINO-PHENYL))ACETATE
Groups experimental
SynonymsMETHYL(2-ACETOXY-2-(2-CARBOXY-4-AMINO-PHENYL))ACETATE

Drug Targets

NameTarget SequencePharmacological ActionActions
Chymotrypsin-like elastase family member 1MLVLYGHSTQDLPETNARVVGGTEAGRNSWPSQISLQYRSGGSRYHTCGG...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 446501