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CHEBI:84630 - vibrioferrin(3−)

ChEBI IDCHEBI:84630
ChEBI Namevibrioferrin(3−)
Stars
ASCII Namevibrioferrin(3-)
DefinitionA tricarboxylic acid trianion resulting from the deprotonation of all three carboxy groups of vibrioferrin. The major species at pH 7.3.
Last Modified3 February 2015
SubmitterGareth Owen
DownloadsMolfile
FormulaC16H19N2O12
Net Charge-3
Average Mass431.330
Monoisotopic Mass431.09544
SMILESC[C@@H](C(=O)NCCOC(=O)C[C@](O)(CC(=O)[O-])C(=O)[O-])N1C(=O)CCC1(O)C(=O)[O-]
InChIInChI=1S/C16H22N2O12/c1-8(18-9(19)2-3-16(18,29)14(26)27)12(23)17-4-5-30-11(22)7-15(28,13(24)25)6-10(20)21/h8,28-29H,2-7H2,1H3,(H,17,23)(H,20,21)(H,24,25)(H,26,27)/p-3/t8-,15+,16?/m0/s1
InChIKeyIGQXNKDXMPSELX-BIAKFKOBSA-K
Roles Classification
Chemical Role:
siderophore  Any of low-molecular-mass iron(III)-chelating compounds produced by microorganisms for the purpose of the transport and sequestration of iron.
Biological Roles:
siderophore  Any of low-molecular-mass iron(III)-chelating compounds produced by microorganisms for the purpose of the transport and sequestration of iron.
marine metabolite  Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
ChEBI Ontology
Outgoing Relation(s)
vibrioferrin(3−) (CHEBI:84630) has role marine metabolite (CHEBI:76507)
vibrioferrin(3−) (CHEBI:84630) has role siderophore (CHEBI:26672)
vibrioferrin(3−) (CHEBI:84630) is a tricarboxylic acid trianion (CHEBI:27092)
vibrioferrin(3−) (CHEBI:84630) is conjugate base of vibrioferrin (CHEBI:84585)
Incoming Relation(s)
iron(III) vibrioferrin (CHEBI:84633) has part vibrioferrin(3−) (CHEBI:84630)
vibrioferrin (CHEBI:84585) is conjugate acid of vibrioferrin(3−) (CHEBI:84630)
IUPAC Name 
(2R)-2-[2-(2-{[(2S)-2-(2-carboxylato-2-hydroxy-5-oxopyrrolidin-1-yl)propanoyl]amino}ethoxy)-2-oxoethyl]-2-hydroxysuccinate