5-beta-Card-20(22)-enolide, 3-beta,14-dihydroxy-, 3-(acetamidoacetate) (ester)

Name: 5-beta-Card-20(22)-enolide, 3-beta,14-dihydroxy-, 3-(acetamidoacetate) (ester)
Brand: CoreyChem
SKU: CAS:42716-84-7
Price: Contact for pricing USD
Availability: InStock

[(3S,5R,10S,13R,14S,17R)-14-hydroxy-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] 2-acetamidoacetate

Also Known As: Digitoxigenin 3-acetylaminoacetate|RefChem:301344|AC1L21CD|Digitoxigenin-3-beta-N-acetylglycyl ester|3-beta,14-Dihydroxy-5-beta-card-20(22)-enolide 3-ester with N-acetylglycine|5-beta-CARD-20(22)-ENOLIDE, 3-beta,14-DIHYDROXY-, 3-(ACETAMIDOACETATE) (ester)|[(3S,5R,10S,13R,14S,17R)-14-hydroxy-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] 2-acetamidoacetate|14-Hydroxy-3-{[N-(1-hydroxyethylidene)glycyl]oxy}card-20(22)-enolide|(8xi,9xi)-14-Hydroxy-3beta-{[N-(1-hydroxyethylidene)glycyl]oxy}-5beta-card-20(22)-enolide|[(3S,5R,10S,13R,14S,17R)-14-Hydroxy-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]2-acetamidoacetate

CAS: 42716-84-7

Molecular Formula	`C27H39NO6`
Molecular Weight	473.27774 g/mol
LogP	3.29
Topological Polar Surface Area	101.93 Å²
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	473.27774
Heavy Atoms	34
Complexity	914.8

Chemical Identifiers

CAS Number	42716-84-7
SMILES	`CC(=O)NCC(=O)O[C@H]1CC[C@]2([C@@H](C1)CCC3C2CC[C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)C`

Product Overview

5-beta-Card-20(22)-enolide, 3-beta,14-dihydroxy-, 3-(acetamidoacetate) (ester) (CAS 42716-84-7), with molecular formula C27H39NO6 and molecular weight 473.27774 g/mol. IUPAC: [(3S,5R,10S,13R,14S,17R)-14-hydroxy-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] 2-acetamidoacetate.

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