Terminology Service for NFDI4Health
JSON

D-octopine

Go to external page http://purl.obolibrary.org/obo/CHEBI_15805

The (1R)-1-carboxyethyl derivative of L-arginine. It is a metabolite released by plant tumours.

Term info

Label

D-octopine

Synonyms
  • D-Octopine
  • D-octopine
  • N(2)-[(1R)-1-carboxyethyl]-L-arginine
database cross reference
Subsets

3_STAR

IUPAC NAME
N(2)-[(1R)-1-carboxyethyl]-L-arginine [ IUPAC ]

charge

0

formula

C9H18N4O4

has alternative id

CHEBI:21810, CHEBI:12631, CHEBI:7366

has obo namespace

chebi_ontology

has related synonym

Arginine, N2-(1-carboxyethyl)-, L-, L-Arginine, N2-(1-carboxyethyl)-, (R)-, N(2)-(D-1-carboxyethyl)-L-arginine, Octopine, L-Arginine, N2-[(1R)-1-carboxyethyl]-, N2-(D-1-Carboxyethyl)-L-arginine, N2-(1-Carboxyethyl)-L-arginine, D-(+)-Octopine

id

CHEBI:15805

inchi

InChI=1S/C9H18N4O4/c1-5(7(14)15)13-6(8(16)17)3-2-4-12-9(10)11/h5-6,13H,2-4H2,1H3,(H,14,15)(H,16,17)(H4,10,11,12)/t5-,6+/m1/s1

inchikey

IMXSCCDUAFEIOE-RITPCOANSA-N

mass

246.26360

monoisotopicmass

246.13281

smiles

C[C@@H](N[C@@H](CCCNC(N)=N)C(O)=O)C(O)=O