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Substance Name: Hydrocinnamic acid, alpha-amino-3-carboxy-2-methoxy-, hydrochloride, DL-
RN: 16220-85-2
InChIKey: ZNBIZHGGHUJJFY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H13-N-O5.Cl-H

Molecular Weight

  • 275.687
 
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Names and Synonyms

Synonym

  • DL-alpha-Amino-3-carboxy-2-methoxyhydrocinnamic acid hydrochloride

Systematic Name

  • Hydrocinnamic acid, alpha-amino-3-carboxy-2-methoxy-, hydrochloride, DL-

Registry Numbers

CAS Registry Number

  • 16220-85-2

System Generated Number

  • 0016220852

Molecular Formulas

Molecular Formula

  • C11-H13-N-O5.Cl-H

Molecular Formula Fragments

  • C11-H13-N-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C11H13NO5.ClH/c1-17-9-6(5-8(12)11(15)16)3-2-4-7(9)10(13)14;/h2-4,8H,5,12H2,1H3,(H,13,14)(H,15,16);1H

InChIKey

ZNBIZHGGHUJJFY-UHFFFAOYSA-N

Smiles

c1c(c(c(cc1)C[C@@H](C(O)=O)N)OC)C(=O)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 3500mg/kg (3500mg/kg)   Journal of Medicinal Chemistry. Vol. 10, Pg. 478, 1967.