Rhodexin A

3-[(3S,5R,8R,9S,10S,11R,13R,14S,17R)-11,14-dihydroxy-10,13-dimethyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one

Also Known As: Rhodexin A|Sarmentogenin-L-rhamnosid|Sarmentogenin 3-O-alpha-L-rhamnoside|Sarmentogenin-L-rhamnosid [German]|3-(6-Deoxy-r-L-mannopyranoside);;|3-(6-deoxy-r-L-mannopyranoside) ;;|Sarmentogenin, 3-(6-deoxy-alpha-L-mannopyranoside)|Sarmentogenin, 3-(6-deoxy-.alpha.-L-mannopyranoside)|3-[(3S,5R,8R,9S,10S,11R,13R,14S,17R)-11,14-dihydroxy-10,13-dimethyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one|Sarmentogenin3beta-(6-deoxy-alpha-L-mannopyranoside)|3beta-[(6-Deoxy-alpha-L-mannopyranosyl)oxy]-11alpha,14-dihydroxy-5beta-card-20(22)-enolide|4-((3S,5R,8R,9S,10S,11R,13R,14S,17R)-11,14-dihydroxy-10,13-dimethyl-3-(((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)furan-2(5H)-one|5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-alpha-L-mannopyranosyl)oxy)-11-alpha,14-dihydroxy-|3-((3S,5R,8R,9S,10S,11R,13R,14S,17R)-11,14-dihydroxy-10,13-dimethyl-3-((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta(a)phenanthren-17-yl)-2H-furan-5-one|4-[(1R,3aS,3bR,5aR,7S,9aS,9bS,10R,11aR)-3a,10-dihydroxy-9a,11a-dimethyl-7-{[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2,5-dihydrofuran-2-one|Card-20(22)-enolide, 3-((6-deoxy-alpha-L-mannopyranosyl)oxy]-11,14-dihydroxy-, (3beta,5beta,11alpha)-

Molecular Formula	C29H44O9
Molecular Weight	536.2985 g/mol
LogP	0.9
Topological Polar Surface Area	146.0 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	9
Rotatable Bonds	3
Exact Mass	536.2985
Monoisotopic Mass	536.2985
Heavy Atoms	38
Complexity	985.0

Chemical Identifiers

CAS Number	545-49-3
SMILES	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3[C@@H](C[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)O)C)O)O)O
InChIKey	HFMLTKBZNAPPNY-CEKKCSHUSA-N