Digoxigenin-beta-tetraacetyl-D-glucoside
Molecular Formula:
C37H52O14
InChI: InChI=1/C37H52O14/c1-18(38)45-17-28-31(47-19(2)39)32(48-20(3)40)33(49-21(4)41)34(51-28)50-24-9-11-35(5)23(14-24)7-8-26-27(35)15-29(42)36(6)25(10-12-37(26,36)44)22-13-30(43)46-16-22/h13,23-29,31-34,42,44H,7-12,14-17H2,1-6H3/t23-,24-,25-,26u,27u,28u,29-,31-,32?,33?,34-,35+,36+,37+/m1/s1
InChIKey: InChIKey=VYLIHPCLJRTEJQ-FXCHFWKUBB
SMILES: CC(=O)OCC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CC(C5(C4(CCC5C6=CC(=O)OC6)O)C)O)C)OC(=O)C)OC(=O)C)OC(=O)C
Names:
BRN 0077014
Card-20(22)-enolide, 12,14-dihydroxy-3-((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)oxy)-, (3-beta,5-beta,12-beta)-
CARD-20(22)-ENOLIDE, 12,14-DIHYDROXY-3-((2,3,4,6-TETRA-O-ACETYL-beta-D-GLUCOPYRA
Digoxigenin-beta-tetraacetyl-D-glucoside
4-18-00-02456 (Beilstein Handbook Reference)
79317-29-6
[(3R,6R)-3,4,5-triacetyloxy-6-[[(3R,5R,10S,12R,13S,14S,17S)-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]oxy]oxan-2-yl]methyl acetate
Registries:
PubChem CID 11967836
PubChem ID 191966
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