| SpectraBase Compound ID | 1U1no7tFYNF |
|---|---|
| InChI | InChI=1S/C26H34O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h3-8,19-23,27H,9-16H2,1-2H3 |
| InChIKey | BGSWILYBWIQYKQ-UHFFFAOYSA-N |
| Mol Weight | 394.6 g/mol |
| Molecular Formula | C26H34O3 |
| Exact Mass | 394.250795 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KsvbW6W4wSS |
|---|---|
| Name | 3-Hydroxyandrost-5-en-17-yl benzoate |
| CAS Registry Number | 1175-12-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H34O3 |
| InChI | InChI=1S/C26H34O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h3-8,19-23,27H,9-16H2,1-2H3 |
| InChIKey | BGSWILYBWIQYKQ-UHFFFAOYSA-N |
| Molecular Weight | 394.555 g/mol |
| SMILES | OC1CCC2(C(C1)=CCC1C2CCC2(C1CCC2OC(=O)c1ccccc1)C)C |
| SPLASH | splash10-0a4i-3910000000-60c25c9273d6c04cd619 |
| Source of Spectrum | NP-14-3248-0 |
| Synonyms | 5-Androstene-3.beta.,17.beta.-diol 17-benzoate Androst-5-ene-3,17-diol, 17-benzoate, (3.beta.,17.beta.)- Androst-5-ene-3.beta.,17.beta.-diol, 17-benzoate Androstan-5-en-3,17-diol, 17-O-benzoyl- (3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) benzoate (10,13-dimethyl-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) benzoate |
| Wiley ID | 1111690 |