![17-ALPHA-[(N-5-AZIDO-2-NITROBENZOYL)-AMIDOPROPYL]-3,3-DIMETHOXY-5-ALPHA-ANDROSTAN-17-BETA-OL](/api/spectrum/36XKqryTwzi/structure.png?h=300&w=458 "17-ALPHA-[(N-5-AZIDO-2-NITROBENZOYL)-AMIDOPROPYL]-3,3-DIMETHOXY-5-ALPHA-ANDROSTAN-17-BETA-OL")
| SpectraBase Compound ID | 5OYJyAz2LSf |
|---|---|
| InChI | InChI=1S/C31H45N5O6/c1-28-15-16-31(41-3,42-4)19-20(28)6-8-22-24(28)10-13-29(2)25(22)11-14-30(29,38)12-5-17-33-27(37)23-18-21(34-35-32)7-9-26(23)36(39)40/h7,9,18,20,22,24-25,38H,5-6,8,10-17,19H2,1-4H3,(H,33,37)/t20-,22+,24-,25-,28-,29-,30-/m0/s1 |
| InChIKey | QXUCWYVCFIGAQF-XIUBKOSJSA-N |
| Mol Weight | 583.7 g/mol |
| Molecular Formula | C31H45N5O6 |
| Exact Mass | 583.336984 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 36XKqryTwzi |
|---|---|
| Name | 17-ALPHA-[(N-5-AZIDO-2-NITROBENZOYL)-AMIDOPROPYL]-3,3-DIMETHOXY-5-ALPHA-ANDROSTAN-17-BETA-OL |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H45N5O6 |
| InChI | InChI=1S/C31H45N5O6/c1-28-15-16-31(41-3,42-4)19-20(28)6-8-22-24(28)10-13-29(2)25(22)11-14-30(29,38)12-5-17-33-27(37)23-18-21(34-35-32)7-9-26(23)36(39)40/h7,9,18,20,22,24-25,38H,5-6,8,10-17,19H2,1-4H3,(H,33,37)/t20-,22+,24-,25-,28-,29-,30-/m0/s1 |
| InChIKey | QXUCWYVCFIGAQF-XIUBKOSJSA-N |
| Literature Reference Author | E.MAPPUS,C.CHAMBON,B.FENET,M.R.DERAVEL,C.GRENOT,C.Y.CUILLERO N |
| Literature Reference Citation | STEROIDS,65,459(2000) |
| Molecular Weight | 583.728 g/mol |
| Sample ID | 968688 |
| Solvent | CDCl3 |