![(E)-17.beta.-[[(5-Oxo-2-imidazolin-2-yl)hydranono]methyl]-5.beta.-androstane-3.beta.,14.beta.-diol](/api/spectrum/FFOvuIPQ7kj/structure.png?h=300&w=458 "(E)-17.beta.-[[(5-Oxo-2-imidazolin-2-yl)hydranono]methyl]-5.beta.-androstane-3.beta.,14.beta.-diol")
| SpectraBase Compound ID | 7H81mxMuSea |
|---|---|
| InChI | InChI=1S/C23H36N4O3/c1-21-8-6-16(28)11-14(21)3-4-18-17(21)7-9-22(2)15(5-10-23(18,22)30)12-25-27-20-24-13-19(29)26-20/h12,14-18,28,30H,3-11,13H2,1-2H3,(H2,24,26,27,29)/b25-12+/t14-,15-,16+,17?,18?,21+,22-,23+/m1/s1 |
| InChIKey | LMKFRTJLDCIUTG-YJAKKMPFSA-N |
| Mol Weight | 416.6 g/mol |
| Molecular Formula | C23H36N4O3 |
| Exact Mass | 416.278741 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FFOvuIPQ7kj |
|---|---|
| Name | (E)-17.beta.-[[(5-Oxo-2-imidazolin-2-yl)hydranono]methyl]-5.beta.-androstane-3.beta.,14.beta.-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H36N4O3 |
| InChI | InChI=1S/C23H36N4O3/c1-21-8-6-16(28)11-14(21)3-4-18-17(21)7-9-22(2)15(5-10-23(18,22)30)12-25-27-20-24-13-19(29)26-20/h12,14-18,28,30H,3-11,13H2,1-2H3,(H2,24,26,27,29)/b25-12+/t14-,15-,16+,17?,18?,21+,22-,23+/m1/s1 |
| InChIKey | LMKFRTJLDCIUTG-YJAKKMPFSA-N |
| Molecular Weight | 416.566 g/mol |
| SMILES | O[C@]1(CC[C@@]2(C3C([C@@]4([C@@]([C@@](\C=N\N=C/5NC(CN5)=O)(CC4)[H])(CC3)C)O)CC[C@@]2(C1)[H])C)[H] |
| SPLASH | splash10-0002-9000000000-72fa9ddeafc0f96a78ce |
| Source of Spectrum | E1-39-3393-13 |
| Wiley ID | 1598901 |