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(EI-0733)Digitoxin

Digitoxin

Catalog Number: EI-0733

CAS Number: 71-63-6

Price: Online Inquiry

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Specifications

Product Information
Molecular Formula C₄₁H₆₄O₁₃
Molecular Weight 764.95
Purity ≥97%
SMILES CC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3O)OC4CCC5(C(C4)CCC6C5CCC7(C6
(CCC7C8=CC(=O)OC8)O)C)C)C)C)O)O
InChi InChI=1S/C41H64O13/c1-20-36(46)29(42)16-34(49-20)53-38-22(3)51-35(18-31(38)44)54-37-21(2)50-33(17-30(37)
43)52-25-8-11-39(4)24(15-25)6-7-28-27(39)9-12-40(5)26(10-13-41(28,40)47)23-14-32(45)48-19-23/h14,20-22,24
-31,33-38,42-44,46-47H,6-13,15-19H2,1-5H3/t20-,21-,22-,24-,25+,26-,27+,28-,29+,30+,31+,33+,34+,35+,36-,37
-,38-,39+,40-,41+/m1/s1
InChi Key WDJUZGPOPHTGOT-XUDUSOBPSA-N
Alternate Name 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]
oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,
16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one, Digitoxoside, Unidigin
Appearance White to off-white solid
Properties
Storage Conditions -20ºC
Shipping Conditions Gel Pack
Solubility ~15 mg/ml in Ethanol

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