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nicotianamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM732378

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	3

formula

C₁₂H₂₁N₃O₆

charge

mass

303.14304

reference

InChIKey

KRGPXXHMOXVMMM-CIUDSAMLSA-N

InChI

InChI=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-/m0/s1

SMILES

[NH3+][C@@H](CC[NH2+][C@@H](CC[NH+]1CC[C@H]1C(=O)[O-])C(=O)[O-])C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58249 chebi:58249	nicotianamine (2S)-1-[(3S)-3-{[(3S)-3-ammonio-3-carboxylatopropyl]ammonio}-3-carboxylatopropyl]azetidinium-2-carboxylate (2S)-1-[(3S)-3-{[(3S)-3-azaniumyl-3-carboxylatopropyl]azaniumyl}-3-carboxylatopropyl]azetidinium-2-carboxylate (S,S,S)-nicotianamine trizwitterion (S,S,S)-nicotianamine zwitterion
CHEBI:62921 chebi:62921	(S,S,S)-nicotianamine monoanion (2S)-1-[(3S)-3-{[(3S)-3-amino-3-carboxylatopropyl]amino}-3-carboxylatopropyl]azetidine-2-carboxylate (2S)-1-[(3S)-3-{[(3S)-3-ammonio-3-carboxylatopropyl]amino}-3-carboxylatopropyl]azetidinium-2-carboxylate (2S)-1-[(3S)-3-{[(3S)-3-azaniumyl-3-carboxylatopropyl]amino}-3-carboxylatopropyl]azetidinium-2-carboxylate
CHEBI:17721 chebi:17721	(S,S,S)-nicotianamine (2S)-1-[(3S)-3-{[(3S)-3-amino-3-carboxypropyl]amino}-3-carboxypropyl]azetidine-2-carboxylic acid Nicotianamine
metacyc.compound:CPD-463 metacycM:CPD-463	L-nicotianamine (S,S,S)-nicotianamine
kegg.compound:C05324 keggC:C05324	Nicotianamine
seed.compound:cpd03158 seedM:cpd03158	Nicotianamine (S,S,S)-nicotianamine L-nicotianamine NA nicotianamine
chebi:14644 chebi:7555 keggC:M_C05324 seedM:M_cpd03158	secondary/obsolete/fantasy identifier