Terminology Service for NFDI4Health
JSON

5-[(4-nitrobenzyl)(phosphonomethyl)amino]valeric acid

Go to external page http://purl.obolibrary.org/obo/CHEBI_40413

A C-nitro compound that is the N-(4-nitrobenzyl),N-phosphonomethyl derivative of 5-aminovaleric acid.

Term info

Label

5-[(4-nitrobenzyl)(phosphonomethyl)amino]valeric acid

Synonyms
  • 5-[(4-nitrobenzyl)(phosphonomethyl)amino]pentanoic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
5-[(4-nitrobenzyl)(phosphonomethyl)amino]pentanoic acid [ IUPAC ]

charge

0

formula

C13H19N2O7P

has obo namespace

chebi_ontology

has related synonym

1-[N-4'-NITROBENZYL-N-4'-CARBOXYBUTYLAMINO]METHYLPHOSPHONIC ACID, 5-[(4-nitrophenyl)methyl-(phosphonomethyl)amino]pentanoic acid, 5-[(4-nitrobenzyl)(phosphonomethyl)amino]pentanoic acid

id

CHEBI:40413

inchi

InChI=1S/C13H19N2O7P/c16-13(17)3-1-2-8-14(10-23(20,21)22)9-11-4-6-12(7-5-11)15(18)19/h4-7H,1-3,8-10H2,(H,16,17)(H2,20,21,22)

inchikey

RWVBLRUMXIXUAR-UHFFFAOYSA-N

mass

346.27290

monoisotopicmass

346.09299

smiles

OC(=O)CCCCN(Cc1ccc(cc1)[N+]([O-])=O)CP(O)(O)=O