Try beta.chemspider
- 10 of 10 defined stereocentres
- Non-standard isotope
4-[7-(beta-D-Glucopyranuronosyloxy)-5-hydroxy-4-oxo-4H-chromen-3-yl](~2~H_4_)phenyl beta-D-glucopyranosiduronic acid
[2H]C1=C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C([2H])=C([2H])C(C2=COC3=CC(=CC(O)=C3C2=O)O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)=C1[2H]
InChI=1S/C27H26O17/c28-12-5-10(42-27-21(35)17(31)19(33)23(44-27)25(38)39)6-13-14(12)15(29)11(7-40-13)8-1-3-9(4-2-8)41-26-20(34)16(30)18(32)22(43-26)24(36)37/h1-7,16-23,26-28,30-35H,(H,36,37)(H,38,39)/t16-,17-,18-,19-,20+,21+,22-,23-,26+,27+/m0/s1/i1D,2D,3D,4D
DFJSPRNCKDBZIJ-DUNIVRNVSA-N
CSID:107443791, http://www.chemspider.com/Chemical-Structure.107443791.html (accessed 21:58, Jul 4, 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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