3-(Acetyloxy)-14-hydroxycard-20(22)-enolide

Name: 3-(Acetyloxy)-14-hydroxycard-20(22)-enolide
Brand: CoreyChem
SKU: CAS:808-19-5
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] acetate

Also Known As: Digitoxigenin acetate, 3-Acetyldigitoxigenin, Digitoxigenin-3-acetate, 3-O-Acetyldigitoxigenin, EINECS 212-363-4, BRN 0097888, 3-(Acetyloxy)-14-hydroxycard-20(22)-enolide, 3-beta-Acetoxy-14-hydroxy-5-beta,14-beta-card-20(22)-enolide, (8xi,9xi)-3beta-(Acetyloxy)-14-hydroxy-5beta-card-20(22)-enolide, Card-20(22)-enolide, 3-(acetyloxy)-14-hydroxy-, (3-beta,5-beta)-, [(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] acetate

CAS: 808-19-5

Molecular Formula	`C25H36O5`
Molecular Weight	416.2563 g/mol
LogP	4.18
Topological Polar Surface Area	72.83 Å²
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	416.2563
Heavy Atoms	30
Complexity	788

Chemical Identifiers

CAS Number	808-19-5
SMILES	`CC(=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

3-(Acetyloxy)-14-hydroxycard-20(22)-enolide (CAS 808-19-5), with molecular formula C25H36O5 and molecular weight 416.2563 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] acetate.

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