MOLI000850
Molecular Formula:
C12H21GdN3O6+3
InChI: InChI=1/C12H21N3O6.Gd/c16-10(17)7-13-1-2-14(8-11(18)19)5-6-15(4-3-13)9-12(20)21;/h1-9H2,(H,16,17)(H,18,19)(H,20,21);/q;+3/f/h16,18,20H;
InChIKey: InChIKey=NFOPCCIRCPLUQF-JRVOPVAUCD
SMILES: C1CN(CCN(CCN1CC(=O)O)CC(=O)O)CC(=O)O.[Gd+3]
Names:
MOLI000850
2-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]acetic acid; gadolinium(+3) cation
Registries:
PubChem CID 450421
PubChem ID 834
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