Glycoside D

(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[(4S,6R,7S,8R,9S,13R)-6-hydroxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

Also Known As: Glycoside D|(3beta,25R)-26-(beta-D-Glucopyranosyloxy)-22-hydroxyfuros T-5-en-3-yl-2-O-(6-deox Y-alpha-L-mannopyranospy)-beta-D-glucopyranoside|beta-D-Glucopyranoside, (3beta,25R)-26-(beta-D-glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-|(2S,3R,4R,5R,6S)-2-((2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(((4S,6R,7S,8R,9S,13R)-6-hydroxy-7,9,13-trimethyl-6-((3R)-3-methyl-4-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxybutyl)-5-oxapentacyclo(10.8.0.02,9.04,8.013,18)icos-18-en-16-yl)oxy)oxan-3-yl)oxy-6-methyloxane-3,4,5-triol|(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[[(4S,6R,7S,8R,9S,13R)-6-hydroxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

Molecular Formula	C45H74O18
Molecular Weight	902.4875 g/mol
LogP	0.4
Topological Polar Surface Area	287.0 Ų
Hydrogen Bond Donors	11
Hydrogen Bond Acceptors	18
Rotatable Bonds	12
Exact Mass	902.4875
Monoisotopic Mass	902.4875
Heavy Atoms	63
Complexity	1610.0

Chemical Identifiers

CAS Number	55972-80-0
SMILES	C[C@H]1[C@H]2[C@H](CC3[C@@]2(CCC4C3CC=C5[C@@]4(CCC(C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O[C@H]7[C@@H]([C@@H]([C@H]([C@@H](O7)C)O)O)O)C)C)O[C@@]1(CC[C@@H](C)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O
InChIKey	KNZSXKKCTOYLSV-VHHWNNOGSA-N