20(R)Ginsenoside Rg2

(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-2-[[(6R,8R,10R,12S,14S,17R)-3,12-dihydroxy-17-[(2R)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

Also Known As: 20(R)Ginsenoside Rg2|20(R)-Ginsenoside Rg2|beta-D-Glucopyranoside, (3beta,6alpha,12beta,20R)-3,12,20-trihydroxydammar-24-en-6-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-|(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-2-[[(6R,8R,10R,12S,14S,17R)-3,12-dihydroxy-17-[(2R)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol|(2S,3R,4R,5R,6S)-2-{[(2R,3R,4S,5S,6R)-2-{[(1R,3aS,3bR,5R,9aR,11S)-7,11-dihydroxy-1-[(2R)-2-hydroxy-6-methylhept-5-en-2-yl]-3a,3b,6,6,9a-pentamethyl-dodecahydro-1H-cyclopenta[a]phenanthren-5-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

Molecular Formula	C42H72O13
Molecular Weight	784.4973 g/mol
LogP	3.2
Topological Polar Surface Area	219.0 Ų
Hydrogen Bond Donors	9
Hydrogen Bond Acceptors	13
Rotatable Bonds	9
Exact Mass	784.4973
Monoisotopic Mass	784.4973
Heavy Atoms	55
Complexity	1390.0

Chemical Identifiers

CAS Number	80952-72-3
SMILES	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2O[C@@H]3C[C@@]4(C(C[C@@H](C5[C@@]4(CC[C@H]5[C@@](C)(CCC=C(C)C)O)C)O)[C@@]6(C3C(C(CC6)O)(C)C)C)C)CO)O)O)O)O)O
InChIKey	AGBCLJAHARWNLA-TZTDDQMKSA-N