1453187-71-7

Phaseoloideside B

IUPAC Name: (2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-(((2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl (4aR,5S,6R,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-(((2R,3R,4R,5S,6R)-3-acetamido-6-((((2S,3R,4S,5S)-3,5-dihydroxy-4-(((2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)methyl)-4-hydroxy-5-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-5,6-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylate

InChIKey: VSYMJJPOZHMPGQ-GCTGGGTHSA-N

SMILES: C(O[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)CO2)[C@@H](O)[C@H](O)[C@@H](CO)O1)(=O)[C@]34[C@](C=5[C@@](C)([C@@H](O)[C@H]3O)[C@@]6(C)[C@](CC5)([C@]7(C)[C@@](CC6)(C(C)(C)[C@@H](O[C@H]8[C@H](NC(C)=O)[C@@H](O)[C@H](O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@H](CO[C@H]%10[C@H](O)[C@@H](O[C@H]%11[C@H](O)[C@@H](O)[C@H](O)CO%11)[C@@H](O)CO%10)O8)CC7)[H])[H])(CC(C)(C)CC4)[H]