| SpectraBase Compound ID | IDhPbS4DaTN |
|---|---|
| InChI | InChI=1S/C21H34O5/c1-13-15(22)16(23)17-18(2,3)7-6-8-19(17,4)21(13)10-9-20(26-21)11-14(24-5)25-12-20/h13-14,16-17,23H,6-12H2,1-5H3/t13-,14+,16-,17+,19+,20-,21-/m1/s1 |
| InChIKey | NZPBUNQOXRUEEE-SRVSUIJFSA-N |
| Mol Weight | 366.5 g/mol |
| Molecular Formula | C21H34O5 |
| Exact Mass | 366.240624 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9pyUngDdXbQ |
|---|---|
| Name | (13R)-9.alpha.,13.alpha.;15,16-diepoxy-6.beta.-hydroxy-15.beta.-methoxylabd-7-one |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H34O5 |
| InChI | InChI=1S/C21H34O5/c1-13-15(22)16(23)17-18(2,3)7-6-8-19(17,4)21(13)10-9-20(26-21)11-14(24-5)25-12-20/h13-14,16-17,23H,6-12H2,1-5H3/t13-,14+,16-,17+,19+,20-,21-/m1/s1 |
| InChIKey | NZPBUNQOXRUEEE-SRVSUIJFSA-N |
| Instrument Name | Micromass 70-250S |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np030480i |
| Molecular Weight | 366.498 g/mol |
| Reported Formula | C21H34O5 |
| SMILES | O[C@]1([C@@]2([C@](CCCC2(C)C)([C@]2([C@@](C1=O)(C)[H])CC[C@@]1(O2)C[C@](OC1)(OC)[H])C)[H])[H] |
| SPLASH | splash10-0bta-4960000000-fb0fd0753caf1eeb6849 |
| Source of Spectrum | G4-67-716-5 |
| Synonyms | 15-epi-Sibiricinone D |
| Wiley ID | 1881736 |