MOLI000474
Molecular Formula:
C24H41GdN5O10+3
InChI: InChI=1/C24H41N5O10.Gd/c30-20(25-11-18-3-1-9-38-18)13-28(16-23(34)35)7-5-27(15-22(32)33)6-8-29(17-24(36)37)14-21(31)26-12-19-4-2-10-39-19;/h18-19H,1-17H2,(H,25,30)(H,26,31)(H,32,33)(H,34,35)(H,36,37);/q;+3/f/h25-26,32,34,36H;
InChIKey: InChIKey=PMJRIDGSCDHYBJ-IASPZRSECC
SMILES: C1CC(OC1)CNC(=O)CN(CCN(CCN(CC(=O)NCC2CCCO2)CC(=O)O)CC(=O)O)CC(=O)O.[Gd+3]
Names:
MOLI000474
2-[2-[carboxymethyl-[2-(carboxymethyl-(oxolan-2-ylmethylcarbamoylmethyl)amino)ethyl]amino]ethyl-(oxolan-2-ylmethylcarbamoylmethyl)amino]acetic acid; gadolinium(+3) cation
Registries:
PubChem CID 450084
PubChem ID 463
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