Try beta.chemspider
- Double-bond stereo
- 16 of 16 defined stereocentres
(1aS,1bS,2S,5aR,6S,6aS)-6-({3-O-Acetyl-6-deoxy-2-O-[(2E)-3-phenyl-2-propenoyl]-beta-D-mannopyranosyl}oxy)-1a-(hydroxymethyl)-1a,1b,2,5a,6,6a-hexahydrooxireno[4,5]cyclopenta[1,2-c]pyran-2-yl beta-D-glu copyranoside
O=C(O[C@H]5[C@@H](OC(=O)C)[C@H](O)[C@H](O[C@H]5O[C@@H]2[C@@H]1O[C@]1(CO)[C@H]3[C@@H](O\C=C/[C@@H]23)O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)CO)C)\C=C\c6ccccc6
InChI=1S/C32H40O16/c1-14-21(37)26(43-15(2)35)27(45-19(36)9-8-16-6-4-3-5-7-16)31(42-14)46-25-17-10-11-41-29(20(17)32(13-34)28(25)48-32)47-30-24(40)23(39)22(38)18(12-33)44-30/h3-11,14,17-18,20-31,33-34,37-40H,12-13H2,1-2H3/b9-8+/t14-,17-,18-,20-,21-,22-,23+,24-,25+,26+,27+,28+,29+,30+,31+,32-/m1/s1
IBXDTZNDJHAVNK-OXHJILIVSA-N
CSID:8592577, http://www.chemspider.com/Chemical-Structure.8592577.html (accessed 00:26, May 22, 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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