- Double-bond stereo
- 4 of 4 defined stereocentres
- Non-standard isotope
(1S,3R,4R,5R)-3-({(2E)-3-[3,4-Dihydroxy(~13~C_6_)phenyl]-2-propenoyl}oxy)-1,4,5-trihydroxycyclohexanecarboxylic acid
[13cH]1[13cH][13c]([13c]([13cH][13c]1/C=C/C(=O)O[C@@H]2C[C@@](C[C@H]([C@H]2O)O)(C(=O)O)O)O)O
InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1/i1+1,3+1,5+1,8+1,9+1,10+1
CWVRJTMFETXNAD-WKFUDWLESA-N
CSID:48058822, http://www.chemspider.com/Chemical-Structure.48058822.html (accessed 00:20, Mar 29, 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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