| SpectraBase Compound ID | HK4YSle5dRU |
|---|---|
| InChI | InChI=1S/C22H34O8/c1-13-10-16-11-19(25)30-21(16)22(27-4)18(29-15(3)23)12-20(26)28-14(2)8-6-5-7-9-17(13)24/h5-7,9,13-14,16-19,21-22,24-25H,8,10-12H2,1-4H3/b6-5+,9-7+/t13-,14-,16-,17+,18-,19?,21+,22+/m1/s1 |
| InChIKey | YBJQWZAYLQQAPP-YBWNOICASA-N |
| Mol Weight | 426.5 g/mol |
| Molecular Formula | C22H34O8 |
| Exact Mass | 426.225368 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BGinfDpSphE |
|---|---|
| Name | Leuconolide A3 hemiacetal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H34O8 |
| InChI | InChI=1S/C22H34O8/c1-13-10-16-11-19(25)30-21(16)22(27-4)18(29-15(3)23)12-20(26)28-14(2)8-6-5-7-9-17(13)24/h5-7,9,13-14,16-19,21-22,24-25H,8,10-12H2,1-4H3/b6-5+,9-7+/t13-,14-,16-,17+,18-,19?,21+,22+/m1/s1 |
| InChIKey | YBJQWZAYLQQAPP-YBWNOICASA-N |
| Molecular Weight | 426.506 g/mol |
| SMILES | OC1O[C@]2([C@](C[C@]([C@](\C=C\C=C\C[C@](OC(C[C@]([C@@]2(OC)[H])(OC(=O)C)[H])=O)(C)[H])(O)[H])(C)[H])(C1)[H])[H] |
| SPLASH | splash10-006x-9810100000-fbe8559de5ae6bae40ae |
| Source of Spectrum | E1-39-2826-3 |
| Wiley ID | 1519195 |