| SpectraBase Compound ID | GrfUPkrak9A |
|---|---|
| InChI | InChI=1S/C23H32O4/c1-3-20(24)23(25)11-8-19-18-5-4-15-14-22(26-12-13-27-22)10-7-16(15)17(18)6-9-21(19,23)2/h6,18-19,25H,3-5,7-14H2,1-2H3/t18-,19+,21+,23+/m1/s1 |
| InChIKey | SZQHALQLUVOQLO-SQVLJLFZSA-N |
| Mol Weight | 372.5 g/mol |
| Molecular Formula | C23H32O4 |
| Exact Mass | 372.23006 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5qfjryja0k9 |
|---|---|
| Name | 3,3-Ethylenedioxy-17.alpha.-hydroxy-17.beta.-(1-oxopropyl)estra-5(10),9(11)-diene |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H32O4 |
| InChI | InChI=1S/C23H32O4/c1-3-20(24)23(25)11-8-19-18-5-4-15-14-22(26-12-13-27-22)10-7-16(15)17(18)6-9-21(19,23)2/h6,18-19,25H,3-5,7-14H2,1-2H3/t18-,19+,21+,23+/m1/s1 |
| InChIKey | SZQHALQLUVOQLO-SQVLJLFZSA-N |
| Molecular Weight | 372.505 g/mol |
| SMILES | O[C@@]1(CC[C@]2([C@@]3(CCC=4CC5(CCC4C3=CC[C@]12C)OCCO5)[H])[H])C(CC)=O |
| SPLASH | splash10-0ab9-9003000000-f78ae42f3cd2bd378e0a |
| Source of Spectrum | OV-1-10-6 |
| Synonyms | 1-[(10'S,11'S,14'R,15'S)-14'-hydroxy-15'-methylspiro[1,3-dioxolane-2,5'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]-1'(17'),2'(7')-dien-14'-yl]propan-1-one 1-[(8S,13S,14S,17R)-17-hydroxy-13-methyl-17-spiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]yl]-1-propanone 1-[(8S,13S,14S,17R)-17-hydroxy-13-methylspiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-yl]propan-1-one 1-[(8S,13S,14S,17R)-13-methyl-17-oxidanyl-spiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-yl]propan-1-one |
| Wiley ID | 1547565 |