Terminology Service for NFDI4Health

5-[(2-aminobenzimidazol-6-yl)amino]-5-oxopentanoic acid zwitterion

Go to external page http://purl.obolibrary.org/obo/CHEBI_63537


A zwitterion obtained by transfer of a proton from the carboxy group to position 3 of the benzimidazole ring of 5-[(2-aminobenzimidazol-6-yl)amino]-5-oxopentanoic acid.

Term info

Label

5-[(2-aminobenzimidazol-6-yl)amino]-5-oxopentanoic acid zwitterion

Synonyms
  • 5-[(2-amino-1H-3,1-benzimidazol-3-ium-6-yl)amino]-5-oxopentanoate
Subsets

3_STAR

IUPAC NAME
5-[(2-amino-1H-3,1-benzimidazol-3-ium-6-yl)amino]-5-oxopentanoate [ IUPAC ]

charge

0

formula

C12H14N4O3

has obo namespace

chebi_ontology

has related synonym

2-amino-6-glutaramidobenzimidazole zwitterion, 5-[(2-amino-3H-benzimidazol-5-yl)amino]-5-oxopentanoic acid zwitterion

id

CHEBI:63537

inchi

InChI=1S/C12H14N4O3/c13-12-15-8-5-4-7(6-9(8)16-12)14-10(17)2-1-3-11(18)19/h4-6H,1-3H2,(H,14,17)(H,18,19)(H3,13,15,16)

inchikey

KYOKAWLLGVBQKM-UHFFFAOYSA-N

mass

262.26460

monoisotopicmass

262.10659

smiles

Nc1[nH]c2cc(NC(=O)CCCC([O-])=O)ccc2[nH+]1