| SpectraBase Compound ID | C3n898Dn7ws |
|---|---|
| InChI | InChI=1S/C25H26O6/c1-13(14(2)26)12-17-23-16(10-11-25(3,4)31-23)19(27)18-20(28)21(29)22(30-24(17)18)15-8-6-5-7-9-15/h5-11,13,21-22,26-27,29H,2,12H2,1,3-4H3/t13-,21-,22+/m0/s1 |
| InChIKey | LLRKBWHPMGVWIT-QVXRUGPVSA-N |
| Mol Weight | 422.48 g/mol |
| Molecular Formula | C25H26O6 |
| Exact Mass | 422.172939 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7K5cz9vxFE |
|---|---|
| Name | Longeracemosone D |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H26O6 |
| InChI | InChI=1S/C25H26O6/c1-13(14(2)26)12-17-23-16(10-11-25(3,4)31-23)19(27)18-20(28)21(29)22(30-24(17)18)15-8-6-5-7-9-15/h5-11,13,21-22,26-27,29H,2,12H2,1,3-4H3/t13-,21-,22+/m0/s1 |
| InChIKey | LLRKBWHPMGVWIT-QVXRUGPVSA-N |
| Molecular Weight | 422.477 g/mol |
| SMILES | Oc1c2c(c(C[C@@](C(=C)O)(C)[H])c3OC(C=Cc13)(C)C)O[C@@]([C@](C2=O)(O)[H])(c1ccccc1)[H] |
| SPLASH | splash10-0udi-0149100000-a993729c6f09844e0d96 |
| Source of Spectrum | U1-2011-3807-4 |
| Wiley ID | 1665651 |