| SpectraBase Compound ID | ibrRqCAROR |
|---|---|
| InChI | InChI=1S/C28H42O7/c1-5-6-7-8-9-24-27(3,31)12-10-21-22(33-24)11-13-28(4)25(34-21)16-23-26(35-28)20(30)15-19(32-23)14-18(2)17-29/h5-7,17,19-26,30-31H,1-2,8-16H2,3-4H3/b7-6+/t19-,20+,21?,22?,23?,24?,25?,26?,27+,28-/m0/s1 |
| InChIKey | HINDCSLBLBWIIV-PWEJLPGQSA-N |
| Mol Weight | 490.6 g/mol |
| Molecular Formula | C28H42O7 |
| Exact Mass | 490.293054 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EeQu00hM5va |
|---|---|
| Name | HEMIBREVETOXIN-B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H42O7 |
| InChI | InChI=1S/C28H42O7/c1-5-6-7-8-9-24-27(3,31)12-10-21-22(33-24)11-13-28(4)25(34-21)16-23-26(35-28)20(30)15-19(32-23)14-18(2)17-29/h5-7,17,19-26,30-31H,1-2,8-16H2,3-4H3/b7-6+/t19-,20+,21?,22?,23?,24?,25?,26?,27+,28-/m0/s1 |
| InChIKey | HINDCSLBLBWIIV-PWEJLPGQSA-N |
| Literature Reference Author | A.V.K.PRASAD,Y.SHIMIZU |
| Literature Reference Citation | J.AM.CHEM.SOC.,111,6476(1989) |
| Literature Reference DOI | 10.1021/ja00198a098 |
| Molecular Weight | 490.637 g/mol |
| Solvent | CD2Cl2 |
| Source File Reference | UWED7535 |