![Impericine [(20R,22S,25S)-5.alpha.-cevanin-23-ene-3.beta.,6.beta.,16.beta.-triol]](/api/spectrum/5HSR9TgRTFo/structure.png?h=300&w=458 "Impericine [(20R,22S,25S)-5.alpha.-cevanin-23-ene-3.beta.,6.beta.,16.beta.-triol]")
| SpectraBase Compound ID | JTgcCAWeNrm |
|---|---|
| InChI | InChI=1S/C27H43NO3/c1-14-4-5-23-15(2)26-20(13-28(23)12-14)17-9-21-19(18(17)10-25(26)31)11-24(30)22-8-16(29)6-7-27(21,22)3/h4-5,14-26,29-31H,6-13H2,1-3H3/t14-,15-,16-,17+,18+,19-,20-,21-,22+,23-,24+,25-,26+,27+/m0/s1 |
| InChIKey | BSHYJFKVJJHKEM-YHIXLZKYSA-N |
| Mol Weight | 429.6 g/mol |
| Molecular Formula | C27H43NO3 |
| Exact Mass | 429.324294 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5HSR9TgRTFo |
|---|---|
| Name | Impericine [(20R,22S,25S)-5.alpha.-cevanin-23-ene-3.beta.,6.beta.,16.beta.-triol] |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H43NO3 |
| InChI | InChI=1S/C27H43NO3/c1-14-4-5-23-15(2)26-20(13-28(23)12-14)17-9-21-19(18(17)10-25(26)31)11-24(30)22-8-16(29)6-7-27(21,22)3/h4-5,14-26,29-31H,6-13H2,1-3H3/t14-,15-,16-,17+,18+,19-,20-,21-,22+,23-,24+,25-,26+,27+/m0/s1 |
| InChIKey | BSHYJFKVJJHKEM-YHIXLZKYSA-N |
| Molecular Weight | 429.645 g/mol |
| SMILES | O[C@]1(CC[C@]2([C@@]([C@@](C[C@]3([C@]4([C@]([C@@]5(CN6[C@]([C@@]([C@]5([C@](C4)(O)[H])[H])(C)[H])(C=C[C@@](C6)(C)[H])[H])[H])(C[C@]23[H])[H])[H])[H])(O)[H])(C1)[H])C)[H] |
| SPLASH | splash10-03di-1900400000-068b59b5929654847498 |
| Source of Spectrum | E2-50-1016-1 |
| Wiley ID | 1555926 |