Try beta.chemspider
- 3 of 5 defined stereocentres
- Non-standard isotope
5-Hydroxy-2-[4-hydroxy(3,5-~2~H_2_)phenyl]-4-oxo(~2~H_3_)-4H-chromen-7-yl beta-D-threo-hexopyranosiduronic acid
C1=C(C=C([2H])C(=C1[2H])O)C2=C([2H])C(=O)C3=C(C([2H])=C(C([2H])=C3O2)O[C@H]4C([C@H]([C@@H](C(C(=O)O)O4)O)O)O)O [2H]c1cc(cc(c1O)[2H])c2c(c(=O)c3c(c(c(c(c3o2)[2H])O[C@H]4C([C@H]([C@@H](C(O4)C(=O)O)O)O)O)[2H])O)[2H]
InChI=1S/C21H18O11/c22-9-3-1-8(2-4-9)13-7-12(24)15-11(23)5-10(6-14(15)31-13)30-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21-23,25-27H,(H,28,29)/t16-,17-,18?,19?,21+/m0/s1/i3D,4D,5D,6D,7D
JBFOLLJCGUCDQP-DFCHULNCSA-N
CSID:58782126, http://www.chemspider.com/Chemical-Structure.58782126.html (accessed 04:47, 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
Advertisement
Spotlight