- 9 of 9 defined stereocentres
(3alpha,5alpha)-3-[2-(Benzyloxy)phenyl]cholestan-3-ol
O(c1ccccc1[C@]5(O)C[C@H]4[C@]([C@@H]3[C@H]([C@H]2[C@]([C@@H]([C@H](C)CCCC(C)C)CC2)(C)CC3)CC4)(C)CC5)Cc6ccccc6
InChI=1S/C40H58O2/c1-28(2)12-11-13-29(3)33-20-21-34-32-19-18-31-26-40(41,25-24-38(31,4)35(32)22-23-39(33,34)5)36-16-9-10-17-37(36)42-27-30-14-7-6-8-15-30/h6-10,14-17,28-29,31-35,41H,11-13,18-27H2,1-5H3/t29-,31+,32+,33-,34+,35+,38+,39-,40-/m1/s1
NPTPWZAJWWNGHK-KCANEJRYSA-N
CSID:8849947, http://www.chemspider.com/Chemical-Structure.8849947.html (accessed 08:40, Mar 29, 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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