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Substance Name: Phenylalanine, 2-(phosphonomethyl)-, hydrate
RN: 110762-24-8
InChIKey: MRGUIJVNFRTRSF-VIFPVBQESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H14-N-O5-P.H2-O

Molecular Weight

  • 259.1966
 
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Names and Synonyms

Synonyms

  • 2-(Phosphonomethyl)phenylalanine hydrate
  • beta-(o-(Dihydroxyphosphinyl)methyl)phenylalanine hydrate

Systematic Name

  • Phenylalanine, 2-(phosphonomethyl)-, hydrate

Registry Numbers

CAS Registry Number

  • 110762-24-8

System Generated Number

  • 0110762248

Molecular Formulas

Molecular Formula

  • C10-H14-N-O5-P.H2-O

Molecular Formula Fragments

  • C10-H14-N-O5-P
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C10H14NO5P/c11-9(10(12)13)5-7-3-1-2-4-8(7)6-17(14,15)16/h1-4,9H,5-6,11H2,(H,12,13)(H2,14,15,16)/t9-/m0/s1

InChIKey

MRGUIJVNFRTRSF-VIFPVBQESA-N

Smiles

c1ccc(c(c1)C[C@@H](C(=O)O)N)CP(=O)(O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 209, 1991.