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staphyloferrin A

Go to external page http://purl.obolibrary.org/obo/CHEBI_84711

A D-ornithine derivative obtained by formal condensation of the terminal carboxy groups of two citric acid units with the two amino groups of D-ornithine.

Term info

Label

staphyloferrin A

Synonyms
  • 2-[2-({(1R)-1-carboxy-4-[(3,4-dicarboxy-3-hydroxybutanoyl)amino]butyl}amino)-2-oxoethyl]-2-hydroxysuccinic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
2-[2-({(1R)-1-carboxy-4-[(3,4-dicarboxy-3-hydroxybutanoyl)amino]butyl}amino)-2-oxoethyl]-2-hydroxysuccinic acid [ IUPAC ]

charge

0

formula

C17H24N2O14

has obo namespace

chebi_ontology

has related synonym

N(2),N(5)-di-(1-oxo-3-hydroxy-3,4-dicarboxybutyl)-D-ornithine

id

CHEBI:84711

inchi

InChI=1S/C17H24N2O14/c20-9(4-16(32,14(28)29)6-11(22)23)18-3-1-2-8(13(26)27)19-10(21)5-17(33,15(30)31)7-12(24)25/h8,32-33H,1-7H2,(H,18,20)(H,19,21)(H,22,23)(H,24,25)(H,26,27)(H,28,29)(H,30,31)/t8-,16?,17?/m1/s1

inchikey

VJSIXUQLTJCRCS-PJPOUAMNSA-N

mass

480.37750

monoisotopicmass

480.12275

smiles

OC(=O)CC(O)(CC(=O)NCCC[C@@H](NC(=O)CC(O)(CC(O)=O)C(O)=O)C(O)=O)C(O)=O