| SpectraBase Compound ID | C5NCiIUvO51 |
|---|---|
| InChI | InChI=1S/C26H43NO2/c1-24-14-12-21(28)18-20(24)9-10-23-22(24)13-15-25(2)19(11-16-26(23,25)29)8-6-4-3-5-7-17-27/h3-4,6,8,19-23,28-29H,5,7,9-18,27H2,1-2H3/b4-3+,8-6+/t19-,20+,21-,22-,23+,24-,25+,26-/m0/s1 |
| InChIKey | SPWMDDDUZSXBQV-ZTTDOWJBSA-N |
| Mol Weight | 401.6 g/mol |
| Molecular Formula | C26H43NO2 |
| Exact Mass | 401.32938 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6Lctu3fIFYL |
|---|---|
| Name | (E,E)-17.beta.(7-Aminohept-1,3-dienyl)-5.beta.-androstane-3.beta.,14.beta.-diol oxalate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H43NO2 |
| InChI | InChI=1S/C26H43NO2/c1-24-14-12-21(28)18-20(24)9-10-23-22(24)13-15-25(2)19(11-16-26(23,25)29)8-6-4-3-5-7-17-27/h3-4,6,8,19-23,28-29H,5,7,9-18,27H2,1-2H3/b4-3+,8-6+/t19-,20+,21-,22-,23+,24-,25+,26-/m0/s1 |
| InChIKey | SPWMDDDUZSXBQV-ZTTDOWJBSA-N |
| Molecular Weight | 401.635 g/mol |
| SMILES | O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@@]([C@@]3(CC[C@@]2(C1)[H])[H])(CC[C@@]4(\C=C\C=C\CCCN)[H])O)C)[H])C)[H] |
| SPLASH | splash10-0udi-0029700000-60e96bf194a029b7ac9c |
| Source of Spectrum | F2-43-2345-37 |
| Synonyms | (1S,2S,5S,7R,10R,11S,14R,15R)-14-[(1E,3E)-7-aminohepta-1,3-dien-1-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane-5,11-diol (3S,5R,8R,9S,10S,13R,14S,17R)-17-[(1E,3E)-7-azanylhepta-1,3-dienyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,14-diol |
| Wiley ID | 1600718 |