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Substance Name: L-Tyrosine, 3-hydroxy-N-L-valyl-, hydrate (2:3)
RN: 52370-54-4
InChIKey: HPTTUQOKNJYJKN-CABZTGNLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H20-N2-O5.3/2H2-O

Molecular Weight

  • 296.321
 
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Names and Synonyms

Synonym

  • 3-Hydroxy-N-L-valyl-L-tyrosine hydrate (2:3)

Systematic Name

  • L-Tyrosine, 3-hydroxy-N-L-valyl-, hydrate (2:3)

Registry Numbers

CAS Registry Number

  • 52370-54-4

System Generated Number

  • 0052370544

Molecular Formulas

Molecular Formula

  • C14-H20-N2-O5.3/2H2-O

Molecular Formula Fragments

  • C14-H20-N2-O5
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C14H20N2O5/c1-7(2)12(15)13(19)16-9(14(20)21)5-8-3-4-10(17)11(18)6-8/h3-4,6-7,9,12,17-18H,5,15H2,1-2H3,(H,16,19)(H,20,21)/t9-,12-/m0/s1

InChIKey

HPTTUQOKNJYJKN-CABZTGNLSA-N

Smiles

CC(C)[C@@H](C(=O)N[C@@H](Cc1ccc(c(c1)O)O)C(=O)O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 422, 1974.