CHEBI:22678 - avenic acid A

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ChEBI Name avenic acid A
ChEBI ID CHEBI:22678
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C12H22N2O8
Net Charge 0
Average Mass 322.31176
Monoisotopic Mass 322.13762
InChI InChI=1S/C12H22N2O8/c15-6-3-8(11(19)20)13-4-1-7(10(17)18)14-5-2-9(16)12(21)22/h7-9,13-16H,1-6H2,(H,17,18)(H,19,20)(H,21,22)
InChIKey QUKMQOBHQMWLLR-UHFFFAOYSA-N
SMILES OCCC(NCCC(NCCC(O)C(O)=O)C(O)=O)C(O)=O
Roles Classification
Chemical Role(s): iron(3+) chelator

Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing avenic acid A (CHEBI:22678) has role iron(3+) chelator (CHEBI:24028)
avenic acid A (CHEBI:22678) is a tricarboxylic acid (CHEBI:27093)
Incoming (R,R,R)-avenic acid A (CHEBI:38153) is a avenic acid A (CHEBI:22678)
(S,S,S)-avenic acid A (CHEBI:38154) is a avenic acid A (CHEBI:22678)
IUPAC Name
N-{3-carboxy-3-[(3-carboxy-3-hydroxypropyl)amino]propyl}homoserine
Synonym Source
AVA ChEBI
Registry Number Type Source
4539525 Beilstein Registry Number Beilstein
Last Modified
25 April 2007