| SpectraBase Compound ID | 9zdwRb65ear |
|---|---|
| InChI | InChI=1S/C26H40O6/c1-16(27)31-18-13-19-23(2,3)8-7-9-25(19,5)26-11-10-24(4,15-26)20(12-17(18)26)32-22(29)14-21(28)30-6/h17-20H,7-15H2,1-6H3/t17-,18+,19?,20-,24+,25+,26+/m1/s1 |
| InChIKey | BVXCYBXEGSWALE-MCZYBKSASA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C26H40O6 |
| Exact Mass | 448.282489 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9YYQJeNp7nJ |
|---|---|
| Name | (-)-Methyl thyrsiflorin B acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H40O6 |
| InChI | InChI=1S/C26H40O6/c1-16(27)31-18-13-19-23(2,3)8-7-9-25(19,5)26-11-10-24(4,15-26)20(12-17(18)26)32-22(29)14-21(28)30-6/h17-20H,7-15H2,1-6H3/t17-,18+,19?,20-,24+,25+,26+/m1/s1 |
| InChIKey | BVXCYBXEGSWALE-MCZYBKSASA-N |
| Molecular Weight | 448.600 g/mol |
| SMILES | [C@@]123[C@@]4(C(C(C)(C)CCC4)C[C@@]([C@]1(C[C@]([C@@](C2)(C)CC3)(OC(CC(=O)OC)=O)[H])[H])(OC(=O)C)[H])C |
| SPLASH | splash10-00di-0096100000-f6484b32d066802dd5f3 |
| Source of Spectrum | J-65-846-9 |
| Wiley ID | 1532158 |