MOLI000461
Molecular Formula:
C29H53GdN3O10+3
InChI: InChI=1/C29H53N3O10.Gd/c1-2-3-4-5-6-7-8-9-10-11-12-14-29(41)42-20-13-15-30(21-25(33)34)16-17-31(22-26(35)36)18-19-32(23-27(37)38)24-28(39)40;/h2-24H2,1H3,(H,33,34)(H,35,36)(H,37,38)(H,39,40);/q;+3/f/h33,35,37,39H;
InChIKey: InChIKey=YWBNOCSTSLSTBW-APIXZNJNCH
SMILES: CCCCCCCCCCCCCC(=O)OCCCN(CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O.[Gd+3]
Names:
MOLI000461
2-[carboxymethyl-[2-[carboxymethyl-[2-(carboxymethyl-(3-tetradecanoyloxypropyl)amino)ethyl]amino]ethyl]amino]acetic acid; gadolinium(+3) cation
Registries:
PubChem CID 450063
PubChem ID 450
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