Try beta.chemspider
- Double-bond stereo
- 2 of 2 defined stereocentres
- Non-standard isotope
[1-({[(1S,3S)-1-{3-[(E)-2-(7-Chloro-2-quinolinyl)vinyl]phenyl}-3-hydroxy-3-{2-[2-hydroxy(~2~H_6_)-2-propanyl]phenyl}propyl]sulfanyl}methyl)cyclopropyl]acetic acid
[2H]C([2H])([2H])C(O)(C1=CC=CC=C1[C@@H](O)C[C@H](SCC1(CC(O)=O)CC1)C1=CC(/C=C/C2=CC=C3C=CC(Cl)=CC3=N2)=CC=C1)C([2H])([2H])[2H]
InChI=1S/C35H36ClNO4S/c1-34(2,41)29-9-4-3-8-28(29)31(38)20-32(42-22-35(16-17-35)21-33(39)40)25-7-5-6-23(18-25)10-14-27-15-12-24-11-13-26(36)19-30(24)37-27/h3-15,18-19,31-32,38,41H,16-17,20-22H2,1-2H3,(H,39,40)/b14-10+/t31-,32-/m0/s1/i1D3,2D3
CHRNGXJVKOMERP-HJOBNDCHSA-N
CSID:78076093, http://www.chemspider.com/Chemical-Structure.78076093.html (accessed 06:24, Jun 6, 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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