3β-Amino-3-deoxydigitoxigenin

Modify Date: 2025-09-11 20:53:51

3β-Amino-3-deoxydigitoxigenin Structure
3β-Amino-3-deoxydigitoxigenin structure
Common Name 3β-Amino-3-deoxydigitoxigenin
CAS Number 216299-46-6 Molecular Weight 586.67300
Density N/A Boiling Point N/A
Molecular Formula C31H42N2O9 Melting Point N/A
MSDS Chinese USA Flash Point N/A

 Names

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
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C31H42N2O9
Molecular Weight 586.67300
Exact Mass 586.28900
PSA 163.03000
LogP 2.86460
InChIKey AVQGRLJRQILBRQ-ZCIIQETRSA-N
SMILES CC12CCC(NC(=O)CCC(=O)ON3C(=O)CCC3=O)CC1CCC1C2CC(O)C2(C)C(C3=CC(=O)OC3)CCC12O

 Synonyms

3|A-Amino-3-deoxydigitoxigenin Hemisuccinate N-Succinimidyl Ester
(3|A,5|A,12|A)-3-[[4-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-1,4-dioxobutyl]amino]-12,14-dihydroxycard-20(22)-enolide
3-Amino-3-deoxydigoxigenin hemisuccinamide,succinimidyl ester
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