![(E)-17.beta.-[[[1-(Methylamino)-2-nitroethenyl]hydranono]methyl]-5.beta.-androstane-3.beta.,14.beta.-diol](/api/spectrum/AKclT91Qm91/structure.png?h=300&w=458 "(E)-17.beta.-[[[1-(Methylamino)-2-nitroethenyl]hydranono]methyl]-5.beta.-androstane-3.beta.,14.beta.-diol")
| SpectraBase Compound ID | AEfRBy2Dbhf |
|---|---|
| InChI | InChI=1S/C23H38N4O4/c1-21-9-7-17(28)12-15(21)4-5-19-18(21)8-10-22(2)16(6-11-23(19,22)29)13-25-26-20(24-3)14-27(30)31/h13,15-19,28-29H,4-12,14H2,1-3H3,(H,24,26)/b25-13+/t15-,16-,17+,18?,19?,21+,22-,23+/m1/s1 |
| InChIKey | MNAILDGHJMTRET-NWULVXLVSA-N |
| Mol Weight | 434.6 g/mol |
| Molecular Formula | C23H38N4O4 |
| Exact Mass | 434.289306 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AKclT91Qm91 |
|---|---|
| Name | (E)-17.beta.-[[[1-(Methylamino)-2-nitroethenyl]hydranono]methyl]-5.beta.-androstane-3.beta.,14.beta.-diol |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H38N4O4 |
| InChI | InChI=1S/C23H38N4O4/c1-21-9-7-17(28)12-15(21)4-5-19-18(21)8-10-22(2)16(6-11-23(19,22)29)13-25-26-20(24-3)14-27(30)31/h13,15-19,28-29H,4-12,14H2,1-3H3,(H,24,26)/b25-13+/t15-,16-,17+,18?,19?,21+,22-,23+/m1/s1 |
| InChIKey | MNAILDGHJMTRET-NWULVXLVSA-N |
| Molecular Weight | 434.581 g/mol |
| SMILES | O[C@]1(CC[C@@]2(C3CC[C@]4([C@@](C3CC[C@@]2(C1)[H])(CC[C@@]4(\C=N\N=C(CN(=O)=O)NC)[H])O)C)C)[H] |
| SPLASH | splash10-00dr-0009200000-98afc8ca42dbe43afe20 |
| Source of Spectrum | E1-39-3393-12 |
| Wiley ID | 1598902 |