Account 2,2'-(4,10-Bis(1,3,4-trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,7-diyl)diacetic acid tetrahydrochloride
- Catalog No. :
- ACTSCF078
- CAS No. :
- 2514736-59-3
- Molecular Formula :
- C20H44Cl4N4O10
- Molecular Weight :
- 642.40
IUPAC Name:2,2'-(4,10-bis(1,3,4-trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,7-diyl)diacetic acid tetrahydrochloride
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Product Information
| Product Name | 2,2'-(4,10-Bis(1,3,4-trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,7-diyl)diacetic acid tetrahydrochloride |
|---|---|
| IUPAC Name | 2,2'-(4,10-bis(1,3,4-trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,7-diyl)diacetic acid tetrahydrochloride |
| Molecular Formula | C20H44Cl4N4O10 |
| Molecular Weight | 642.40 |
| SMILES | OCC(O)C(N1CCN(CC(O)=O)CCN(C(C(O)CO)CO)CCN(CC(O)=O)CC1)CO.[H]Cl.[H]Cl.[H]Cl.[H]Cl |
| InChI Key | PHHDNGZEDDMDIM-UHFFFAOYSA-N |
| Synonym | 1,4,7,10-Tetraazacyclododecane-1,7-diacetic acid, 4,10-bis[2,3-dihydroxy-1-(hydroxymethyl)propyl]-, hydrochloride (1:4);Gadobutrol EP Impurity A (4 Hydrochloride);GadobutrolEPImpurityA4HCl;Gadobutrol Impurity 1 4HCl;Gadobutrol EP Impurity A 4HCl (Mixture of Diastereomers);Gadobitol EP Impurity A(4 hydrochloride);Gadobutrol Impurity 1 Hydrochloride |
| CAS No. | 2514736-59-3 |
Synthetic Route by SureRoute
2. ACTSCF078 Molecular Building Block Synthetic Route
2,2',2''-(10-(1,3,4-Trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic acid
rel-Calcium 2,2'-(7-(carboxymethyl)-10-((2R,3S)-1,3,4-trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,4-diyl)diacetate
rel-2,2',2''-(10-((2R,3S)-1,3,4-Trihydroxybutan-2-yl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic acid