2-[[2-[2-[bis(carboxymethyl)carbamoylmethyl-(2-tetradecanoyloxyethyl)amino]ethyl-(2-tetradecanoyloxyethyl)amino]acetyl]-(carboxymethyl)amino]acetic acid; gadolinium
Molecular Formula:
C46H82GdN4O14
InChI: InChI=1/C46H82N4O14.Gd/c1-3-5-7-9-11-13-15-17-19-21-23-25-45(61)63-31-29-47(33-39(51)49(35-41(53)54)36-42(55)56)27-28-48(34-40(52)50(37-43(57)58)38-44(59)60)30-32-64-46(62)26-24-22-20-18-16-14-12-10-8-6-4-2;/h3-38H2,1-2H3,(H,53,54)(H,55,56)(H,57,58)(H,59,60);/f/h53,55,57,59H;
InChIKey: InChIKey=NAVMABXXCNFFFQ-GMSMFSBLCZ
SMILES: CCCCCCCCCCCCCC(=O)OCCN(CCN(CCOC(=O)CCCCCCCCCCCCC)CC(=O)N(CC(=O)O)CC(=O)O)CC(=O)N(CC(=O)O)CC(=O)O.[Gd]
Names:
2-[[2-[2-[bis(carboxymethyl)carbamoylmethyl-(2-tetradecanoyloxyethyl)amino]ethyl-(2-tetradecanoyloxyethyl)amino]acetyl]-(carboxymethyl)amino]acetic acid; gadolinium
Registries:
PubChem CID 10510328
PubChem ID 15535221
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