Try beta.chemspider
- 10 of 10 defined stereocentres
(3S)-3-[(3S,5R,8R,9R,10S,12R,13R,14R,17S)-3,12-Dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl]butanoic acid (non-preferred name)
C[C@@H](CC(O)=O)[C@@H]1CC[C@@H]2[C@@H]3CC[C@@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3C[C@@H](O)[C@@]21C
InChI=1S/C23H38O4/c1-13(10-21(26)27)17-6-7-18-16-5-4-14-11-15(24)8-9-22(14,2)19(16)12-20(25)23(17,18)3/h13-20,24-25H,4-12H2,1-3H3,(H,26,27)/t13-,14+,15-,16-,17-,18+,19+,20+,22-,23+/m0/s1
PLRQOCVIINWCFA-MDIYGMIZSA-N
CSID:96316816, http://www.chemspider.com/Chemical-Structure.96316816.html (accessed 11:41, Apr 26, 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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