ziyuglycoside II structure

ziyuglycoside II

(1R,4aS,6bR,10S,12aR,14bS)-1-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-10-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

Also Known As: ziyuglycoside II|Ziyu glycoside II|(1R,4aS,6bR,10S,12aR,14bS)-1-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-10-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

CAS: 35286-59-0
Molecular Formula C35H56O8
Molecular Weight 604.3975 g/mol
LogP 4.6677
Topological Polar Surface Area 136.68 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 7
Rotatable Bonds 3
Exact Mass 604.3975
Monoisotopic Mass 604.3975
Heavy Atoms 43
Complexity 1164.485

Chemical Identifiers

CAS Number 35286-59-0
SMILES CC1CC[C@@]2(CCC3(C(=CCC4[C@]3(CCC5[C@@]4(CC[C@@H](C5(C)C)O[C@H]6[C@@H]([C@H]([C@@H](CO6)O)O)O)C)C)[C@@H]2[C@]1(C)O)C)C(=O)O

Product Overview

ziyuglycoside II (CAS 35286-59-0), with molecular formula C35H56O8 and molecular weight 604.3975 g/mol. IUPAC: (1R,4aS,6bR,10S,12aR,14bS)-1-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-10-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid.

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