- Double-bond stereo
- 8 of 8 defined stereocentres
5-{(E)-2-[(2S,3R,4S)-5-Carboxy-2-(beta-D-glucopyranosyloxy)-3-vinyl-3,4-dihydro-2H-pyran-4-yl]vinyl}-1-(2-hydroxyethyl)-3-pyridiniumcarboxylate
C=C[C@@H]1[C@@H](C(=CO[C@H]1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)O)/C=C/c3cc(c[n+](c3)CCO)C(=O)[O-]
InChI=1S/C24H29NO12/c1-2-14-15(4-3-12-7-13(21(31)32)9-25(8-12)5-6-26)16(22(33)34)11-35-23(14)37-24-20(30)19(29)18(28)17(10-27)36-24/h2-4,7-9,11,14-15,17-20,23-24,26-30H,1,5-6,10H2,(H-,31,32,33,34)/b4-3+/t14-,15+,17-,18-,19+,20-,23+,24+/m1/s1
DXFHNEGQVDLRDO-KBCYOOEFSA-N
CSID:23340729, http://www.chemspider.com/Chemical-Structure.23340729.html (accessed 20:45, Mar 28, 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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