| SpectraBase Compound ID | EMLLhLJrUDI |
|---|---|
| InChI | InChI=1S/C25H38O6/c1-13(2)7-6-8-14(3)17-10-9-15(4)20-18(17)11-16(5)24(22(20)28)31-25-23(29)21(27)19(26)12-30-25/h7,11,14-15,17,19,21,23,25-29H,6,8-10,12H2,1-5H3/t14-,15-,17+,19+,21+,23-,25-/m0/s1 |
| InChIKey | FEZCZZKMZMBVOU-PSCZYRQKSA-N |
| Mol Weight | 434.6 g/mol |
| Molecular Formula | C25H38O6 |
| Exact Mass | 434.266839 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5HNbeYzkQ4 |
|---|---|
| Name | (1S,4R,11S)-8-O-Glycosyl-seco-Pseudopterosin J (7-Hydroxy-8-methoxyserrulat-14-ene) |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H38O6 |
| InChI | InChI=1S/C25H38O6/c1-13(2)7-6-8-14(3)17-10-9-15(4)20-18(17)11-16(5)24(22(20)28)31-25-23(29)21(27)19(26)12-30-25/h7,11,14-15,17,19,21,23,25-29H,6,8-10,12H2,1-5H3/t14-,15-,17+,19+,21+,23-,25-/m0/s1 |
| InChIKey | FEZCZZKMZMBVOU-PSCZYRQKSA-N |
| Molecular Weight | 434.573 g/mol |
| SMILES | Oc1c2c(cc(c1O[C@]1([C@]([C@@]([C@@](CO1)(O)[H])(O)[H])(O)[H])[H])C)[C@](CC[C@@]2(C)[H])([C@](CCC=C(C)C)(C)[H])[H] |
| SPLASH | splash10-0g4l-4944100000-78c8a8ce6f61558be48b |
| Source of Spectrum | F-62-4212-8 |
| Wiley ID | 1633066 |