Products 2260795-19-3
CAS 2260795-19-3 appears in our catalog under these names: 18:0 PE-DTPA (Gd) (diammonium), 18:0 PE-dtpa (GD). Offered by: MedChemExpress, Sigma-Aldrich. Available pack sizes: Get quote, 5MG.
Diazanium;oxidanium;2-[2-[bis(carboxylatomethyl)amino]ethyl-[2-[carboxylatomethyl-[2-[2-[[(2R)-2,3-di(octadecanoyloxy)propoxy]-oxidophosphoryl]oxyethylamino]-2-oxoethyl]amino]ethyl]amino]acetate;gadolinium(3+) (CAS 2260795-19-3) is a chemical compound with the molecular formula C55H109GdN6O18P+ and a molecular weight of 1330.7 g/mol. IUPAC name: diazanium;oxidanium;2-[2-[bis(carboxylatomethyl)amino]ethyl-[2-[carboxylatomethyl-[2-[2-[[(2R)-2,3-di(octadecanoyloxy)propoxy]-oxidophosphoryl]oxyethylamino]-2-oxoethyl]amino]ethyl]amino]acetate;gadolinium(3+). InChIKey: DTISROVBRQZRES-OMHNTWRYSA-L.
| Molecular formula | C55H109GdN6O18P+ |
|---|---|
| Molecular weight | 1330.7 g/mol |
| IUPAC name | diazanium;oxidanium;2-[2-[bis(carboxylatomethyl)amino]ethyl-[2-[carboxylatomethyl-[2-[2-[[(2R)-2,3-di(octadecanoyloxy)propoxy]-oxidophosphoryl]oxyethylamino]-2-oxoethyl]amino]ethyl]amino]acetate;gadolinium(3+) |
| InChIKey | DTISROVBRQZRES-OMHNTWRYSA-L |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CN(CCN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])OC(=O)CCCCCCCCCCCCCCCCC.[NH4+].[NH4+].[OH3+].[Gd+3] |
Computed by PubChem (NCBI)
Synonyms:
orb3144732