Try beta.chemspider
- 5 of 5 defined stereocentres
- Non-standard isotope
(16alpha)-3,16-Dihydroxy(2,4,6,6,9-~2~H_5_)estra-1(10),2,4-trien-17-one
C[C@@]12CC[C@]3([2H])C4=CC([2H])=C(C([2H])=C4C([2H])([2H])C[C@H]3[C@@H]2C[C@H](C1=O)O)O [2H]c1cc2c(c(c1O)[2H])C(C[C@@H]3[C@@]2(CC[C@]4([C@H]3C[C@H](C4=O)O)C)[2H])([2H])[2H]
InChI=1S/C18H22O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-16,19-20H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,18+/m1/s1/i2D2,3D,8D,13D
WPOCIZJTELRQMF-DNBUVWEKSA-N
CSID:58783790, http://www.chemspider.com/Chemical-Structure.58783790.html (accessed 15:45, 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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