17,21-Dihydroxypregn-4-ene-3,20-dione-21,21-d2
CAS Registry Number®
1271728-08-5
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CAS Name
17,21-Dihydroxypregn-4-ene-3,20-dione-21,21-d2Molecular Formula
C21H28D2O4Cite this Page
17,21-Dihydroxypregn-4-ene-3,20-dione-21,21-d2. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1271728-08-5 (retrieved ) (CAS RN: 1271728-08-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15-,16+,17+,19+,20+,21+/m1/s1/i12D2
InChIKey
InChIKey=WHBHBVVOGNECLV-FAWVBKBISA-N
SMILES
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(CC3)=CC(=O)CC4)(CC1)[H])[H])(CC[C@@]2(C(C(O)([2H])[2H])=O)O)[H]
Canonical SMILES
O=C1C=C2CCC3C(CCC4(C)C3CCC4(O)C(=O)CO)C2(C)CC1
Other Names for this Substance
- Pregn-4-ene-3,20-dione-21,21-d2, 17,21-dihydroxy-
- 17,21-Dihydroxypregn-4-ene-3,20-dione-21,21-d2