Try beta.chemspider
- Double-bond stereo
- 10 of 10 defined stereocentres
(1S)-1,5-Anhydro-1-[5-hydroxy-7-({6-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoyl]-beta-D-glucopyranosyl}oxy)-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-D-glucitol
O=C(OC[C@H]5O[C@@H](Oc2cc4O/C(c1ccc(O)cc1)=C\C(=O)c4c(O)c2[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO)[C@H](O)[C@@H](O)[C@@H]5O)\C=C\c6cc(OC)c(O)c(OC)c6
InChI=1S/C38H40O19/c1-51-22-9-15(10-23(52-2)29(22)43)3-8-26(42)53-14-25-31(45)34(48)36(50)38(57-25)56-21-12-20-27(18(41)11-19(54-20)16-4-6-17(40)7-5-16)32(46)28(21)37-35(49)33(47)30(44)24(13-39)55-37/h3-12,24-25,30-31,33-40,43-50H,13-14H2,1-2H3/b8-3+/t24-,25-,30-,31-,33+,34+,35-,36-,37+,38-/m1/s1
AGLOWEFNIHNCIZ-VFHIEQPNSA-N
CSID:8852160, http://www.chemspider.com/Chemical-Structure.8852160.html (accessed 20:52, Apr 26, 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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