| SpectraBase Spectrum ID |
7hannfzy2TI |
| Name |
11.beta.,20-Dihydroxy-3-oxopregn-4-en-21-al |
| Alternate Name(s) |
(11beta)-11,20-dihydroxy-3-oxopregn-4-en-21-al |
| CAS Registry Number |
59005-58-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30O4 |
| InChI |
InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,11,14-19,24-25H,3-8,10H2,1-2H3/t14-,15-,16+,17-,18?,19+,20-,21-/m0/s1 |
| InChIKey |
SNSWNKAIXNDOKX-LPQWTHIFSA-N |
| Molecular Weight |
346.467 g/mol |
| SMILES |
O[C@@]1([C@@]2([C@@]3(C(CC[C@]2([C@]2([C@@]([C@@](C(C=O)O)(CC2)[H])(C1)C)[H])[H])=CC(CC3)=O)C)[H])[H] |
| SPLASH |
splash10-014i-0049000000-4392b7495bb9c5bf4916 |
| Source of Spectrum |
J-41-2479-0 |
| Wiley ID |
1339491 |
