| SpectraBase Compound ID | 2UEbQkhviwk |
|---|---|
| InChI | InChI=1S/C26H37ClO10/c1-15-11-19-12-24(35-18(4)29)37-25(19)26(32-5)21(34-17(3)28)13-22(30)33-16(2)9-7-6-8-10-20(15)36-23(31)14-27/h6-8,10,15-16,19-21,24-26H,9,11-14H2,1-5H3/b7-6+,10-8+/t15-,16-,19-,20+,21-,24-,25+,26-/m1/s1 |
| InChIKey | HNRUAMNDAJSRJE-IQGDBXCUSA-N |
| Mol Weight | 545.0 g/mol |
| Molecular Formula | C26H37ClO10 |
| Exact Mass | 544.207525 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CUElSZQltL5 |
|---|---|
| Name | .beta.-9-O-Chloroleuconolide A3 Acetoxyacetal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H37ClO10 |
| InChI | InChI=1S/C26H37ClO10/c1-15-11-19-12-24(35-18(4)29)37-25(19)26(32-5)21(34-17(3)28)13-22(30)33-16(2)9-7-6-8-10-20(15)36-23(31)14-27/h6-8,10,15-16,19-21,24-26H,9,11-14H2,1-5H3/b7-6+,10-8+/t15-,16-,19-,20+,21-,24-,25+,26-/m1/s1 |
| InChIKey | HNRUAMNDAJSRJE-IQGDBXCUSA-N |
| Molecular Weight | 545.025 g/mol |
| SMILES | [C@@]12([C@@]([C@@](CC(O[C@@](C\C=C\C=C\[C@@]([C@@](C[C@@]2(C[C@@](O1)(OC(=O)C)[H])[H])(C)[H])(OC(=O)CCl)[H])(C)[H])=O)(OC(=O)C)[H])(OC)[H])[H] |
| SPLASH | splash10-0596-9400000000-91a7a52f106c9716b5f1 |
| Source of Spectrum | E1-39-2826-21 |
| Wiley ID | 1519199 |