73039-13-1

Chrysanthellin A

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

InChIKey: IBEZGTWSSFFKNB-JZEXCKIOSA-N

SMILES: O[C@H]1[C@@](C(O[C@@H](OC[C@@H](O)[C@@H]2O)[C@@H]2O[C@@H]3[C@H](O)[C@H](O)[C@@H](O[C@H](OC[C@H]4O)[C@H](O)[C@H]4O[C@@H]5[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O5)[C@H](C)O3)=O)(CCC(C)(C)C6)[C@@]6([H])C7=CC[C@@]8([H])[C@](CC[C@]9([H])[C@]8(C)CC[C@H](O[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)C9(C)C)(C)[C@]7(C)C1