Try beta.chemspider
- 26 of 28 defined stereocentres
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] (1S,4aR,6aR,6aS,6bR,10S,12aR)-1-hydroxy-10-[(2R,3R,4S,5S)-5-hydroxy-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy]tetrahydropyran-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
O=C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@]93C(/C2=C/C[C@H]8[C@](C)([C@]2(C)CC3)CCC7[C@]8(C)CC[C@H](O[C@H]6OC[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H]6O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C7(C)C)[C@H](O)C(C)(C)CC9
InChI=1S/C53H86O23/c1-48(2)14-16-53(47(68)76-45-39(66)36(63)33(60)26(20-56)72-45)17-15-51(6)22(30(53)42(48)67)8-9-28-50(5)12-11-29(49(3,4)27(50)10-13-52(28,51)7)73-46-41(75-44-38(65)35(62)32(59)25(19-55)71-44)40(23(57)21-69-46)74-43-37(64)34(61)31(58)24(18-54)70-43/h8,23-46,54-67H,9-21H2,1-7H3/t23-,24+,25+,26+,27?,28+,29-,30?,31+,32+,33+,34-,35-,36-,37+,38+,39+,40-,41+,42-,43-,44-,45-,46+,50-,51+,52+,53-/m0/s1
FQZBLKYWRWOSAD-DKSHBBNXSA-N
CSID:8526650, http://www.chemspider.com/Chemical-Structure.8526650.html (accessed 17:54, Apr 25, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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