Account 2,5-dioxopyrrolidin-1-yl 4-(((3S,5R,8R,9S,10S,12R,13S,14S,17R)-12,14-dihydroxy-10,13-dimethyl-17-(5-oxo-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)amino)-4-oxobutanoate
- Catalog No. :
- ACIGBL612
- CAS No. :
- 216299-46-6
- Molecular Formula :
- C31H42N2O9
- Molecular Weight :
- 586.29
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-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)amino)-4-oxobutanoate
![2,5-dioxopyrrolidin-1-yl 4-(((3S,5R,8R,9S,10S,12R,13S,14S,17R)-12,14-dihydroxy-10,13-dimethyl-17-(5-oxo-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)amino)-4-oxobutanoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product 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-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)amino)-4-oxobutanoate |
|---|---|
| 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-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)amino)-4-oxobutanoate |
| Molecular Formula | C31H42N2O9 |
| Molecular Weight | 586.29 |
| SMILES | O[C@@]12[C@@]([C@@H](C3=CC(OC3)=O)CC1)([C@@H](C[C@@]4([H])[C@@]2([H])CC[C@@]5([H])[C@@]4(CC[C@@H](C5)NC(CCC(ON6C(CCC6=O)=O)=O)=O)C)O)C |
| InChI Key | AVQGRLJRQILBRQ-ZCIIQETRSA-N |
| Synonym | 3β-Amino-3-deoxydigitoxigenin;3β-Amino-3-deoxydigitoxigenin Hemisuccinate N-Succinimidyl Ester;32-Amino-3-deoxydigitoxigenin Hemisuccinate N-Succinimidyl Ester;3β-Amino-3-deoxydigoxigenin hemisuccinamide, succinimidyl ester, 80%, single isomer;3-Amino-3-Deoxydigoxigenin Hemisuccimide, Succinimidyl Ester;Card-20(22)-enolide, 3-[[4-[(2,5-dioxo-1-pyrrolidinyl)oxy]-1,4-dioxobutyl]amino]-12,14-dihydroxy-, (3β,5β,12β)-;3β-Amino-3-Deoxydigoxigenin Hemisuccinamide Succinimidyl Ester |
| CAS No. | 216299-46-6 |
Synthetic Route by SureRoute
2. ACIGBL612 Molecular Building Block Synthetic Route
2,5-Dioxopyrrolidin-1-yl 6-(2-(((3S,5R,8R,9S,10S,12R,13S,14S,17R)-12,14-dihydroxy-10,13-dimethyl-17-(5-oxo-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)acetamido)hexanoate