- Double-bond stereo
- 8 of 8 defined stereocentres
1-(3-Carboxypropyl)-5-{(E)-2-[(2S,3R,4S)-2-(beta-D-glucopyranosyloxy)-5-(methoxycarbonyl)-3-vinyl-3,4-dihydro-2H-pyran-4-yl]vinyl}-3-pyridiniumcarboxylate
COC(=O)C1=CO[C@H]([C@@H]([C@@H]1/C=C/c2cc(c[n+](c2)CCCC(=O)O)C(=O)[O-])C=C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
InChI=1S/C27H33NO13/c1-3-16-17(7-6-14-9-15(24(35)36)11-28(10-14)8-4-5-20(30)31)18(25(37)38-2)13-39-26(16)41-27-23(34)22(33)21(32)19(12-29)40-27/h3,6-7,9-11,13,16-17,19,21-23,26-27,29,32-34H,1,4-5,8,12H2,2H3,(H-,30,31,35,36)/b7-6+/t16-,17+,19-,21-,22+,23-,26+,27+/m1/s1
DRYLFSKCXKHLKH-XBRJNPSZSA-N
CSID:23340727, http://www.chemspider.com/Chemical-Structure.23340727.html (accessed 17:28, Apr 20, 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
Advertisement
Spotlight