Digitoxigenin-beta-tetraacetyl-d-glucoside

Name: Digitoxigenin-beta-tetraacetyl-d-glucoside
Brand: CoreyChem
SKU: CAS:35068-75-8
Price: Contact for pricing USD
Availability: InStock

[(3R,6R)-3,4,5-triacetyloxy-6-[[(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]oxy]oxan-2-yl]methyl acetate

Also Known As: RefChem:338191|AC1L1WW6|Digitoxigenin-beta-tetraacetyl-d-glucoside|(3beta,5beta)-14-Hydroxy-3-(2,3,4,6-tetraacetyl-beta-D-glucopyranosyloxy)card-20(22)-enolide|Card-20(22)-enolide, 14-hydroxy-3-((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)oxy)-, (3-beta,5-beta)-|14-Hydroxy-3-[(2,3,4,6-tetra-O-acetylhexopyranosyl)oxy]card-20(22)-enolide|(8xi,9xi)-14-Hydroxy-3beta-[(2,3,4,6-tetra-O-acetyl-beta-D-glycero-hexopyranosyl)oxy]-5beta-card-20(22)-enolide|[(3R,6R)-3,4,5-triacetyloxy-6-[[(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]oxy]oxan-2-yl]methyl acetate

CAS: 35068-75-8

Molecular Formula	`C37H52O13`
Molecular Weight	704.3408 g/mol
LogP	3.71
Topological Polar Surface Area	170.19 Å²
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	13
Rotatable Bonds	8
Exact Mass	704.3408
Heavy Atoms	50
Complexity	1409.0

Chemical Identifiers

CAS Number	35068-75-8
SMILES	`CC(=O)OCC1[C@H](C(C([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CCC4C3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C)OC(=O)C)OC(=O)C)OC(=O)C`

Product Overview

Digitoxigenin-beta-tetraacetyl-d-glucoside (CAS 35068-75-8), with molecular formula C37H52O13 and molecular weight 704.3408 g/mol. IUPAC: [(3R,6R)-3,4,5-triacetyloxy-6-[[(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]oxy]oxan-2-yl]methyl acetate.

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