| SpectraBase Compound ID | 6bdytzAWHmU |
|---|---|
| InChI | InChI=1S/C21H30O4/c1-20-8-7-15-13(14(20)5-6-16(20)19(25)11-22)4-3-12-9-17(23)18(24)10-21(12,15)2/h9,13-16,18,22,24H,3-8,10-11H2,1-2H3 |
| InChIKey | KYRHFGKXGJXOGD-UHFFFAOYSA-N |
| Mol Weight | 346.47 g/mol |
| Molecular Formula | C21H30O4 |
| Exact Mass | 346.214409 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AsVVAs7siF4 |
|---|---|
| Name | Pregn-4-ene-3,20-dione, 2,21-dihydroxy-, (2.alpha.)- |
| Alternate Name(s) | 2,21-Dihydroxypregn-4-ene-3,20-dione 10,13-dimethyl-2-oxidanyl-17-(2-oxidanylethanoyl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 17-glycoloyl-2-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 2-Hydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 2-Hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one |
| CAS Registry Number | 56196-78-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30O4 |
| InChI | InChI=1S/C21H30O4/c1-20-8-7-15-13(14(20)5-6-16(20)19(25)11-22)4-3-12-9-17(23)18(24)10-21(12,15)2/h9,13-16,18,22,24H,3-8,10-11H2,1-2H3 |
| InChIKey | KYRHFGKXGJXOGD-UHFFFAOYSA-N |
| Molecular Weight | 346.467 g/mol |
| SMILES | OCC(C1C2(C(C3C(C4(C(=CC(C(C4)O)=O)CC3)C)CC2)CC1)C)=O |
| SPLASH | splash10-014i-6946000000-4edd696b48c665cefdad |
| Source of Spectrum | EP-1400-0-0 |
| Wiley ID | 1339447 |