3-Monoacetylgitoxigenin

Name: 3-Monoacetylgitoxigenin
Brand: CoreyChem
SKU: CAS:1059-21-8
Price: Contact for pricing USD
Availability: InStock

[(3S,5R,10S,13R,14S,16S,17R)-14,16-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] acetate

Also Known As: 3-Monoacetylgitoxigenin, gitoxigenin 3-acetate, BRN 0061015, 4-18-00-02458 (Beilstein Handbook Reference), 3-beta,14,16-beta-Trihydroxy-5-beta-card-20(22)-enolide 3-acetate, 5-beta-CARD-20(22)-ENOLIDE, 3-beta,14,16-beta-TRIHYDROXY-, 3-ACETATE, [(3S,5R,10S,13R,14S,16S,17R)-14,16-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] acetate, 3-beta,14,16-beta-Trihyroxy-5-beta-card-20(22)-enolide 3-acetate

CAS: 1059-21-8

Molecular Formula	`C25H36O6`
Molecular Weight	432.2512 g/mol
LogP	3.15
Topological Polar Surface Area	93.06 Å²
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	432.2512
Heavy Atoms	31
Complexity	820

Chemical Identifiers

CAS Number	1059-21-8
SMILES	`CC(=O)O[C@H]1CC[C@]2([C@@H](C1)CCC3C2CC[C@]4([C@@]3(C[C@@H]([C@@H]4C5=CC(=O)OC5)O)O)C)C`

Product Overview

3-Monoacetylgitoxigenin (CAS 1059-21-8), with molecular formula C25H36O6 and molecular weight 432.2512 g/mol. IUPAC: [(3S,5R,10S,13R,14S,16S,17R)-14,16-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] acetate.

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