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Metildigoxin

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Metildigoxin / CAS : 30685-43-9

Appearance solid UN -
HS 29389090 DG Class -
Synonyms B-Methyldigoxin; Medigoxin; 4'''-O-Methyldigoxin; 4'''-Methyldigoxin; Lanitop; 4'''-B-Methyldigoxin; Digoxin,4'''-O-Methyl-(8Ci); Beta-Methyldigoxin; Unii-I7Gg1Yuc5V
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Properties

Summary

Formula
C42H66O14
Molecular Mass
794.96500
Exact Mass
794.44500
PSA
192.06000
Logp
2.87220
IUPAC
3-[(3S,5R,8R,9S,10S,12R,13S,14S,17R)-12,14-dihydroxy-3-[(2R,4S,5S,6R)-4-hydroxy-5-[(2S,4S,5S,6R)-4-hydroxy-5-[(2S,4S,5S,6R)-4-hydroxy-5-methoxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-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
SMILES
C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5C[C@H]([C@]7([C@@]6(CC[C@@H]7C8=CC(=O)OC8)O)C)O)C)C)C)O)OC

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Density
1.33g/cm3
Boiling Point
914.1ºC
Flash Point
270.5ºC
Appearance
solid
Acidity and Basicity
neutral

Export information

HS Code
29389090
Export Rebate
13%

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