Try beta.chemspider
- 16 of 16 defined stereocentres
1-O-[(2alpha,3beta)-2,3,19-Trihydroxy-28-oxours-12-en-28-yl]-beta-D-glucopyranose
O=C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@]56CC[C@]3(C)/C(=C\C[C@@H]2[C@@]4(C)C[C@@H](O)[C@H](O)[C@@](C)(C)[C@@H]4CC[C@]23C)[C@@H]6[C@](C)(O)[C@H](C)CC5
InChI=1S/C36H58O10/c1-18-10-13-36(30(43)46-29-26(41)25(40)24(39)21(17-37)45-29)15-14-33(5)19(27(36)35(18,7)44)8-9-23-32(4)16-20(38)28(42)31(2,3)22(32)11-12-34(23,33)6/h8,18,20-29,37-42,44H,9-17H2,1-7H3/t18-,20-,21-,22+,23-,24-,25+,26-,27-,28+,29+,32+,33-,34-,35-,36+/m1/s1
MLKQAGPAYHTNQQ-BRDPIYJESA-N
CSID:19985275, http://www.chemspider.com/Chemical-Structure.19985275.html (accessed 10:48, Apr 23, 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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