| SpectraBase Compound ID | BZzAmTviu96 |
|---|---|
| InChI | InChI=1S/C29H40O10/c1-17(9-12-30)13-23(34)35-15-28-11-10-26(3)24(39-26)25(28)38-21-14-20(27(28,4)29(21)16-36-29)37-22(33)8-6-5-7-19(32)18(2)31/h5-8,13,18-21,24-25,30-32H,9-12,14-16H2,1-4H3/b7-5+,8-6-,17-13+/t18-,19+,20+,21?,24?,25?,26?,27+,28?,29?/m0/s1 |
| InChIKey | WEMJGJUXWJHCES-VFLLTVJWSA-N |
| Mol Weight | 548.6 g/mol |
| Molecular Formula | C29H40O10 |
| Exact Mass | 548.262147 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ipnkgYP6Nb |
|---|---|
| Name | 9-BETA,10-BETA-EPOXYISOTRICHOVERRIN-A |
| Compound Number | 11A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H40O10 |
| InChI | InChI=1S/C29H40O10/c1-17(9-12-30)13-23(34)35-15-28-11-10-26(3)24(39-26)25(28)38-21-14-20(27(28,4)29(21)16-36-29)37-22(33)8-6-5-7-19(32)18(2)31/h5-8,13,18-21,24-25,30-32H,9-12,14-16H2,1-4H3/b7-5+,8-6-,17-13+/t18-,19+,20+,21?,24?,25?,26?,27+,28?,29?/m0/s1 |
| InChIKey | WEMJGJUXWJHCES-VFLLTVJWSA-N |
| Literature Reference Author | B.B.JARVIS,S.WANG,H.L.AMMON |
| Literature Reference Citation | J.NAT.PROD.,59,254(1996) |
| Literature Reference DOI | 10.1021/np960078m |
| Molecular Weight | 548.631 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP2322 |