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Substance Name: Alanine, 3-(3,4-dihydroxyphenyl)-, benzyl ester, hydrochloride, L-
RN: 37178-28-2
InChIKey: SJFUQIANPBDPDH-UHFFFAOYSA-N

Molecular Formula

  • C16-H17-N-O4.Cl-H

Molecular Weight

  • 323.774
 
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Names and Synonyms

Synonyms

  • 3,4-Dihydroxy-L-phenylalanine benzyl ester hydrochloride
  • L-Dopa benzyl ester hydrochloride

Systematic Name

  • Alanine, 3-(3,4-dihydroxyphenyl)-, benzyl ester, hydrochloride, L-

Registry Numbers

CAS Registry Number

  • 37178-28-2

System Generated Number

  • 0037178282

Molecular Formulas

Molecular Formula

  • C16-H17-N-O4.Cl-H

Molecular Formula Fragments

  • C16-H17-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H17NO4.ClH/c17-13(8-12-6-7-14(18)15(19)9-12)16(20)21-10-11-4-2-1-3-5-11;/h1-7,9,13,18-19H,8,10,17H2;1H

InChIKey

SJFUQIANPBDPDH-UHFFFAOYSA-N

Smiles

c1(C[C@@H](C(OCc2ccccc2)=O)[NH3+])cc(c(O)cc1)O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 4300mg/kg (4300mg/kg) SENSE ORGANS AND SPECIAL SENSES: OTHER: EYE Journal of Medicinal Chemistry. Vol. 20, Pg. 1435, 1977.