Try beta.chemspider
- Double-bond stereo
- 6 of 6 defined stereocentres
- Non-standard isotope
(3E,8R,9S,10R,13S,14S,17R)-13-Ethyl-17-ethynyl-3-(hydroxyimino)(2,2,4,6,6,10-~2~H_6_)-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-ol (non-preferred name)
[H][C@]12CC[C@@](O)(C#C)[C@@]2(CC)CC[C@]3([H])[C@@]4([2H])CC([2H])([2H])/C(=N\O)/C([2H])=C4C([2H])([2H])C[C@]31[H] [2H][C@]12CC([2H])([2H])/C(=N\O)/C([2H])=C1C([2H])([2H])C[C@@H]1[C@@H]2CC[C@@]2(CC)[C@H]1CC[C@@]2(O)C#C
InChI=1S/C21H29NO2/c1-3-20-11-9-17-16-8-6-15(22-24)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23-24H,3,5-12H2,1H3/b22-15+/t16-,17+,18+,19-,20-,21-/m0/s1/i5D2,6D2,13D,16D
ISHXLNHNDMZNMC-LLWUDOGESA-N
CSID:73986490, http://www.chemspider.com/Chemical-Structure.73986490.html (accessed 18:57, May 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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