| SpectraBase Compound ID | 4qTkJD7Qr6b |
|---|---|
| InChI | InChI=1S/C34H48O3/c1-4-5-6-7-8-12-15-25-16-17-28-31-29(19-21-33(25,28)2)34(3)20-18-27(22-26(34)23-30(31)35)37-32(36)24-13-10-9-11-14-24/h9-11,13-14,23,25,27-29,31H,4-8,12,15-22H2,1-3H3/t25?,27-,28-,29-,31-,33+,34-/m0/s1 |
| InChIKey | NATCHKRHZPGCPG-PHQBFTDDSA-N |
| Mol Weight | 504.8 g/mol |
| Molecular Formula | C34H48O3 |
| Exact Mass | 504.360345 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2qlaoT8C3Vf |
|---|---|
| Name | 3.beta.-(Benzoyloxy)-7-oxo-17-octyl-5-androstene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H48O3 |
| InChI | InChI=1S/C34H48O3/c1-4-5-6-7-8-12-15-25-16-17-28-31-29(19-21-33(25,28)2)34(3)20-18-27(22-26(34)23-30(31)35)37-32(36)24-13-10-9-11-14-24/h9-11,13-14,23,25,27-29,31H,4-8,12,15-22H2,1-3H3/t25?,27-,28-,29-,31-,33+,34-/m0/s1 |
| InChIKey | NATCHKRHZPGCPG-PHQBFTDDSA-N |
| Molecular Weight | 504.755 g/mol |
| SMILES | [C@]12(C(=CC([C@]3([C@@]4(CCC([C@]4(CC[C@]23[H])C)CCCCCCCC)[H])[H])=O)C[C@@](OC(=O)c2ccccc2)(CC1)[H])C |
| SPLASH | splash10-0l1i-2903000000-ad6ebafe9b90f44c9143 |
| Source of Spectrum | C-118-7729-22c |
| Wiley ID | 1698648 |