Try beta.chemspider
- 5 of 5 defined stereocentres
- Non-standard isotope
{[(1R,2R,3aS,9aS)-2-Hydroxy-1-[(3S)-3-hydroxyoctyl](1,2,3,3-~2~H_4_)-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[b]naphthalen-5-yl]oxy}acetic acid
CCCCC[C@@H](CC[C@]1([2H])[C@H]2CC3=C(C[C@H]2C([2H])([2H])[C@@]1([2H])O)C(=CC=C3)OCC(=O)O)O [2H][C@]1([C@H]2Cc3cccc(c3C[C@H]2C([C@@]1([2H])O)([2H])[2H])OCC(=O)O)CC[C@H](CCCCC)O
InChI=1S/C23H34O5/c1-2-3-4-7-17(24)9-10-18-19-11-15-6-5-8-22(28-14-23(26)27)20(15)12-16(19)13-21(18)25/h5-6,8,16-19,21,24-25H,2-4,7,9-14H2,1H3,(H,26,27)/t16-,17-,18+,19-,21+/m0/s1/i13D2,18D,21D
PAJMKGZZBBTTOY-ADGJBYSCSA-N
CSID:58784095, http://www.chemspider.com/Chemical-Structure.58784095.html (accessed 11:09, Apr 24, 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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