[(2S,3R,4R,5S,6R)-5-acetoxy-4-[(2R,3R,4S,5S)-3-[(2R,3R,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-3-hydroxy-6-methyl-tetrahydropyran-2-yl] (4aS,6aR,6aR,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-10-hydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

More details:

• Systematic name

  [(2S,3R,4R,5S,6R)-5-acetoxy-4-[(2R,3R,4S,5S)-3-[(2R,3R,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-3-hydroxy-6-methyl-tetrahydropyran-2-yl] (4aS,6aR,6aR,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-10-hydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

• SMILES

  O=C[C@]9(C)[C@@H](O)CC[C@@]8(C)[C@H]9CC[C@]7(C)[C@@H]8C/C=C5\[C@]7(C)CC[C@]6(C(=O)O[C@@H]4O[C@H](C)[C@H](OC(=O)C)[C@H](O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[C@H]2O[C@@H](C)[C@H](O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)[C@H]2O)[C@H]4O)[C@H]5CC(C)(C)CC6

• Std. InChi

  InChI=1S/C54H84O21/c1-24-40(72-44-37(63)34(60)29(58)22-67-44)36(62)38(64)45(68-24)74-43-35(61)30(21-55)71-47(43)73-42-39(65)46(69-25(2)41(42)70-26(3)57)75-48(66)54-18-16-49(4,5)20-28(54)27-10-11-32-50(6)14-13-33(59)51(7,23-56)31(50)12-15-53(32,9)52(27,8)17-19-54/h10,23-25,28-47,55,58-65H,11-22H2,1-9H3/t24-,25+,28-,29+,30-,31+,32+,33-,34-,35-,36-,37+,38+,39+,40-,41-,42+,43+,44-,45+,46-,47+,50-,51-,52-,53+,54-/m0/s1

• Std. InChIKey

  SVHGVDVDHWOBCQ-LLFJKUTHSA-N

• Cite this record

  CSID:8947785, http://www.chemspider.com/Chemical-Structure.8947785.html (accessed 18:28, Apr 26, 2024)