| SpectraBase Compound ID | c2xzl8A7lt |
|---|---|
| InChI | InChI=1S/C20H26O3/c1-12(21)23-14-4-6-15-13(11-14)3-5-17-16(15)9-10-20(2)18(17)7-8-19(20)22/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3/t16?,17?,18?,19-,20-/m0/s1 |
| InChIKey | FHXBMXJMKMWVRG-OQPPHWFISA-N |
| Mol Weight | 314.43 g/mol |
| Molecular Formula | C20H26O3 |
| Exact Mass | 314.188195 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9EVgJ8ORCn4 |
|---|---|
| Name | (17.beta.)estra-1,3,5(10)triene-3-acetoxy-17-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H26O3 |
| InChI | InChI=1S/C20H26O3/c1-12(21)23-14-4-6-15-13(11-14)3-5-17-16(15)9-10-20(2)18(17)7-8-19(20)22/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3/t16?,17?,18?,19-,20-/m0/s1 |
| InChIKey | FHXBMXJMKMWVRG-OQPPHWFISA-N |
| Molecular Weight | 314.425 g/mol |
| SMILES | O[C@@]1([C@@]2(C(C3CCc4c(C3CC2)ccc(OC(=O)C)c4)CC1)C)[H] |
| SPLASH | splash10-03l1-0924000000-96f2fc9f0b9e5a074cad |
| Source of Spectrum | CJ-1992-0-0 |
| Synonyms | (17beta)-17-hydroxyestra-1,3,5(10)-trien-3-yl acetate Acetic acid[(13S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]ester [(13S,17S)-13-methyl-17-oxidanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]ethanoate [(13S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]acetate [(13S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] acetate [(13S,17S)-13-methyl-17-oxidanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] ethanoate |
| Wiley ID | 1315420 |