| SpectraBase Compound ID | LMlESJrQPkk |
|---|---|
| InChI | InChI=1S/C24H32O7/c1-15-8-7-11-24(6,31-17(3)26)13-9-18-19(20(27)10-12-23(4,5)28)14-29-22(21(15)18)30-16(2)25/h7,10-12,14,18,21-22,28H,1,8-9,13H2,2-6H3/b11-7+,12-10+/t18-,21+,22?,24-/m1/s1 |
| InChIKey | HQKMATXOYCWETH-VKCJDNFKSA-N |
| Mol Weight | 432.5 g/mol |
| Molecular Formula | C24H32O7 |
| Exact Mass | 432.214803 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KlJxl0LkFFl |
|---|---|
| Name | Tsitsixenicin C |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H32O7 |
| InChI | InChI=1S/C24H32O7/c1-15-8-7-11-24(6,31-17(3)26)13-9-18-19(20(27)10-12-23(4,5)28)14-29-22(21(15)18)30-16(2)25/h7,10-12,14,18,21-22,28H,1,8-9,13H2,2-6H3/b11-7+,12-10+/t18-,21+,22?,24-/m1/s1 |
| InChIKey | HQKMATXOYCWETH-VKCJDNFKSA-N |
| Molecular Weight | 432.513 g/mol |
| SMILES | OC(\C=C\C(C=1[C@@]2([C@@](C(=C)C\C=C\[C@](CC2)(OC(=O)C)C)([H])C(OC1)OC(=O)C)[H])=O)(C)C |
| SPLASH | splash10-0006-9000000000-fde47258ab45e3057258 |
| Source of Spectrum | F-51-9982-11 |
| Wiley ID | 793376 |