| SpectraBase Compound ID | K87jQ2dkrAG |
|---|---|
| InChI | InChI=1S/C20H24O7/c1-8-4-12(21)15(23)18(3)10(8)5-13-19-7-26-17(24)20(25,16(18)19)9(2)11(19)6-14(22)27-13/h4,9-11,13,15-16,23,25H,5-7H2,1-3H3 |
| InChIKey | XCAPDGKSNAMUQC-UHFFFAOYSA-N |
| Mol Weight | 376.41 g/mol |
| Molecular Formula | C20H24O7 |
| Exact Mass | 376.152203 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AuGxnmdQJLi |
|---|---|
| Name | Shinjudilactone |
| CAS Registry Number | 80180-30-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H24O7 |
| InChI | InChI=1S/C20H24O7/c1-8-4-12(21)15(23)18(3)10(8)5-13-19-7-26-17(24)20(25,16(18)19)9(2)11(19)6-14(22)27-13/h4,9-11,13,15-16,23,25H,5-7H2,1-3H3 |
| InChIKey | XCAPDGKSNAMUQC-UHFFFAOYSA-N |
| Molecular Weight | 376.405 g/mol |
| SMILES | OC1C2(C(CC3OC(CC4C33C2C(C4C)(C(OC3)=O)O)=O)C(=CC1=O)C)C |
| SPLASH | splash10-0f9b-2029000000-4986c57e8a9882136739 |
| Source of Spectrum | AJ-56-3691-1 |
| Wiley ID | 1357682 |