CAS 216299-46-6 is the registry number for 3β-Amino-3-deoxydigitoxigenin Hemisuccinate N-Succinimidyl Ester, 80%, 80%. Offered by: Chemat. Available pack sizes: 5mg.
(2,5-dioxopyrrolidin-1-yl) 4-[[(3S,5R,8R,9S,10S,12R,13S,14S,17R)-12,14-dihydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]amino]-4-oxobutanoate (CAS 216299-46-6) is a chemical compound with the molecular formula C31H42N2O9 and a molecular weight of 586.7 g/mol. IUPAC name: (2,5-dioxopyrrolidin-1-yl) 4-[[(3S,5R,8R,9S,10S,12R,13S,14S,17R)-12,14-dihydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]amino]-4-oxobutanoate. InChIKey: AVQGRLJRQILBRQ-ZCIIQETRSA-N.
| Molecular formula | C31H42N2O9 |
|---|---|
| Molecular weight | 586.7 g/mol |
| IUPAC name | (2,5-dioxopyrrolidin-1-yl) 4-[[(3S,5R,8R,9S,10S,12R,13S,14S,17R)-12,14-dihydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]amino]-4-oxobutanoate |
| InChIKey | AVQGRLJRQILBRQ-ZCIIQETRSA-N |
| SMILES | C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2C[C@H]([C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O)NC(=O)CCC(=O)ON6C(=O)CCC6=O |
Computed by PubChem (NCBI)