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- 2 of 3 defined stereocentres
1-Phenylethanaminium 1,4-bis{[(2R)-2-ethyl-5-hexen-1-yl]oxy}-1,4-dioxo-2-butanesulfonate
CC[C@H](CCC=C)COC(=O)CC(C(=O)OC[C@H](CC)CCC=C)S(=O)(=O)[O-].CC(c1ccccc1)[NH3+]
InChI=1S/C20H34O7S.C8H11N/c1-5-9-11-16(7-3)14-26-19(21)13-18(28(23,24)25)20(22)27-15-17(8-4)12-10-6-2;1-7(9)8-5-3-2-4-6-8/h5-6,16-18H,1-2,7-15H2,3-4H3,(H,23,24,25);2-7H,9H2,1H3/t16-,17-,18?;/m1./s1
BAVQGGBSJTVLQA-CEYVOKQTSA-N
CSID:29316574, http://www.chemspider.com/Chemical-Structure.29316574.html (accessed 01:49, Jun 8, 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
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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