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CHEBI:38115 - (S,R,R)-nicotianamine

ChEBI IDCHEBI:38115
ChEBI Name(S,R,R)-nicotianamine
Stars
ASCII Name(S,R,R)-nicotianamine
Last Modified10 March 2014
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC12H21N3O6
Net Charge0
Average Mass303.315
Monoisotopic Mass303.14304
SMILESN[C@H](CCN[C@H](CCN1CC[C@H]1C(=O)O)C(=O)O)C(=O)O
InChIInChI=1S/C12H21N3O6/c13-7(10(16)17)1-4-14-8(11(18)19)2-5-15-6-3-9(15)12(20)21/h7-9,14H,1-6,13H2,(H,16,17)(H,18,19)(H,20,21)/t7-,8-,9+/m1/s1
InChIKeyKRGPXXHMOXVMMM-HLTSFMKQSA-N
Roles Classification
Chemical Roles:
phytosiderophore  Any of low-molecular-mass iron(III)-chelating compounds produced by plants for the purpose of the transport and sequestration of iron.
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
phytosiderophore  Any of low-molecular-mass iron(III)-chelating compounds produced by plants for the purpose of the transport and sequestration of iron.
ChEBI Ontology
Outgoing Relation(s)
(S,R,R)-nicotianamine (CHEBI:38115) has functional parent (S)-azetidine-2-carboxylic acid (CHEBI:6198)
(S,R,R)-nicotianamine (CHEBI:38115) is a nicotianamine (CHEBI:25520)
(S,R,R)-nicotianamine (CHEBI:38115) is enantiomer of (R,S,S)-nicotianamine (CHEBI:38114)
Incoming Relation(s)
(R,S,S)-nicotianamine (CHEBI:38114) is enantiomer of (S,R,R)-nicotianamine (CHEBI:38115)
IUPAC Name 
(2S)-1-[(3R)-3-{[(3R)-3-amino-3-carboxypropyl]amino}-3-carboxypropyl]azetidine-2-carboxylic acid
Registry NumbersSources
Beilstein:6611716Beilstein