| SpectraBase Compound ID | IRTgLaKB1Ee |
|---|---|
| InChI | InChI=1S/C26H36O8/c1-15-9-22(34-18(4)29)24-25(5,14-32-16(2)27)11-20(33-17(3)28)12-26(24,6)21(15)8-7-19-10-23(30)31-13-19/h10,20,22,24H,7-9,11-14H2,1-6H3/t20-,22-,24-,25+,26+/m0/s1 |
| InChIKey | ABQWYWRVKQLRRE-ZFNQBEQJSA-N |
| Mol Weight | 476.6 g/mol |
| Molecular Formula | C26H36O8 |
| Exact Mass | 476.241018 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FFgkoTuAFJk |
|---|---|
| Name | Amoenolide A - 2,6,19-triacetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H36O8 |
| InChI | InChI=1S/C26H36O8/c1-15-9-22(34-18(4)29)24-25(5,14-32-16(2)27)11-20(33-17(3)28)12-26(24,6)21(15)8-7-19-10-23(30)31-13-19/h10,20,22,24H,7-9,11-14H2,1-6H3/t20-,22-,24-,25+,26+/m0/s1 |
| InChIKey | ABQWYWRVKQLRRE-ZFNQBEQJSA-N |
| Molecular Weight | 476.566 g/mol |
| SMILES | [C@@]12(C(=C(C)C[C@@]([C@]2([C@](COC(=O)C)(C)C[C@@](C1)(OC(=O)C)[H])[H])(OC(=O)C)[H])CCC1=CC(=O)OC1)C |
| SPLASH | splash10-0006-9000000000-dcb83310893fe72de60a |
| Source of Spectrum | X2-57-774-5 |
| Wiley ID | 1605485 |