Try beta.chemspider
- Double-bond stereo
- 5 of 5 defined stereocentres
(1S,3R,5Z,7E,13alpha,14beta)-9,10-Secocholesta-5,7,10,16-tetraen-23-yne-1,3,25-triol
CC(C)(O)C#CC[C@@H](C)C1=CC[C@@H]2C(CCC[C@@]12C)=C/C=C1/C[C@@H](O)C[C@H](O)C/1=C
InChI=1S/C27H38O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-12,18,22,24-25,28-30H,2,7-9,13,15-17H2,1,3-5H3/b20-10?,21-11-/t18-,22-,24-,25+,27+/m1/s1
JKFZMIQMKFWJAY-HVTNTQLSSA-N
CSID:114813951, http://www.chemspider.com/Chemical-Structure.114813951.html (accessed 16:15, Jun 16, 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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