| SpectraBase Compound ID | KDeNwC6zLo8 |
|---|---|
| InChI | InChI=1S/C21H32O4/c1-12(22)21(25)9-7-16-15-5-4-13-10-14(23)6-8-19(13,2)18(15)17(24)11-20(16,21)3/h13-16,18,23,25H,4-11H2,1-3H3 |
| InChIKey | AYEXSTRNLGYBSQ-UHFFFAOYSA-N |
| Mol Weight | 348.5 g/mol |
| Molecular Formula | C21H32O4 |
| Exact Mass | 348.23006 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | H2d51sJMQdD |
|---|---|
| Name | Pregnane-11,20-dione, 3,17-dihydroxy- |
| Alternate Name(s) | 3,17-Dihydroxypregnane-11,20-dione (3alpha,5beta)-3,17-dihydroxypregnane-11,20-dione 17-acetyl-3,17-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-11-one 17-ethanoyl-10,13-dimethyl-3,17-bis(oxidanyl)-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-11-one Pregnane-3,17-diol-11,20-dione |
| CAS Registry Number | 56193-64-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H32O4 |
| InChI | InChI=1S/C21H32O4/c1-12(22)21(25)9-7-16-15-5-4-13-10-14(23)6-8-19(13,2)18(15)17(24)11-20(16,21)3/h13-16,18,23,25H,4-11H2,1-3H3 |
| InChIKey | AYEXSTRNLGYBSQ-UHFFFAOYSA-N |
| Molecular Weight | 348.483 g/mol |
| SMILES | OC1CC2CCC3C4C(C(CC4)(C(=O)C)O)(CC(C3C2(CC1)C)=O)C |
| SPLASH | splash10-0006-8941000000-61202954350530d7bf01 |
| Source of Spectrum | EP-1336-0-0 |
| Wiley ID | 1340815 |