| SpectraBase Compound ID | Ga54D9l1f58 |
|---|---|
| InChI | InChI=1S/C38H52N2O5/c1-35-15-11-25-23(6-10-30-37(25,3)17-13-31(41)40-30)28(35)19-21(20-35)33(43)45-34(44)27-8-7-24-22-5-9-29-38(4,18-14-32(42)39-29)26(22)12-16-36(24,27)2/h8,20,22-26,28-30H,5-7,9-19H2,1-4H3,(H,39,42)(H,40,41)/t22-,23+,24-,25-,26-,28-,29+,30+,35+,36-,37+,38+/m0/s1 |
| InChIKey | YVLHNKCOZKTDSQ-ZYEWWUPZSA-N |
| Mol Weight | 616.8 g/mol |
| Molecular Formula | C38H52N2O5 |
| Exact Mass | 616.387623 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ag29EpSXCTa |
|---|---|
| Name | 4-AZA-ANDROST-16-EN-3-ON-17-CARBOXYLIC-ANHYDRIDE |
| Compound Number | 6B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H52N2O5 |
| InChI | InChI=1S/C38H52N2O5/c1-35-15-11-25-23(6-10-30-37(25,3)17-13-31(41)40-30)28(35)19-21(20-35)33(43)45-34(44)27-8-7-24-22-5-9-29-38(4,18-14-32(42)39-29)26(22)12-16-36(24,27)2/h8,20,22-26,28-30H,5-7,9-19H2,1-4H3,(H,39,42)(H,40,41)/t22-,23+,24-,25-,26-,28-,29+,30+,35+,36-,37+,38+/m0/s1 |
| InChIKey | YVLHNKCOZKTDSQ-ZYEWWUPZSA-N |
| Literature Reference Author | R.SKODA-FOULDES,Z.CSAKAI,L.KOLLAR,G.SZALONTAI,J.HORVATH,Z.TU BA |
| Literature Reference Citation | STEROIDS,60,786(1995) |
| Literature Reference DOI | 10.1016/0039-128x(95)00120-f |
| Molecular Weight | 616.841 g/mol |
| Source File Reference | UWLU73918 |