- 4 of 4 defined stereocentres
(1R,2R,4S,5R)-2-(1-Benzothiophen-5-ylmethyl)-1,4,5-trihydroxy-3-oxocyclohexanecarboxylic acid
c1cc2c(ccs2)cc1CC3C(=O)C(C(CC3(C(=O)O)O)O)O
InChI=1S/C16H16O6S/c17-11-7-16(22,15(20)21)10(13(18)14(11)19)6-8-1-2-12-9(5-8)3-4-23-12/h1-5,10-11,14,17,19,22H,6-7H2,(H,20,21)/t10-,11+,14-,16+/m0/s1
WFQJMZIPFQUOBR-FJXFWJLJSA-N
CSID:35035746, http://www.chemspider.com/Chemical-Structure.35035746.html (accessed 21:01, Dec 3, 2023)
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