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- 5 of 6 defined stereocentres
- Non-standard isotope
(8S,9S,10R,13S,14S,17S)-13-Ethyl-17-(~13~C_2_)ethynyl-11-methylene(16,16-~2~H_2_)-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-ol (non-preferred name)
CC[C@@]12CC(=C)[C@@H]3C4CCCC=C4CC[C@H]3[C@@H]2CC([2H])([2H])[C@@]1([13C]#[13CH])O [2H]C1(C[C@H]2[C@@H]3CCC4=CCCCC4[C@H]3C(=C)C[C@@]2([C@]1([13C]#[13CH])O)CC)[2H]
InChI=1S/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17?,18-,19-,20+,21-,22+/m0/s1/i2+1,5+1,13D2
RPLCPCMSCLEKRS-WVGMEZOOSA-N
CSID:58780712, http://www.chemspider.com/Chemical-Structure.58780712.html (accessed 06:46, May 8, 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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