| SpectraBase Compound ID | JjsP5h0ry2 |
|---|---|
| InChI | InChI=1S/C20H30O5/c1-13-8-17(23)20-12-25-19(20,11-21)6-3-4-16(20)18(13,2)9-15(22)14-5-7-24-10-14/h5,7,10,13,15-17,21-23H,3-4,6,8-9,11-12H2,1-2H3/t13-,15+,16-,17+,18?,19+,20+/m1/s1 |
| InChIKey | QTKUKPZFMJWCPE-FUGYQKQMSA-N |
| Mol Weight | 350.46 g/mol |
| Molecular Formula | C20H30O5 |
| Exact Mass | 350.209324 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4HRqsTmdMI5 |
|---|---|
| Name | Teumassilenin C |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O5 |
| InChI | InChI=1S/C20H30O5/c1-13-8-17(23)20-12-25-19(20,11-21)6-3-4-16(20)18(13,2)9-15(22)14-5-7-24-10-14/h5,7,10,13,15-17,21-23H,3-4,6,8-9,11-12H2,1-2H3/t13-,15+,16-,17+,18?,19+,20+/m1/s1 |
| InChIKey | QTKUKPZFMJWCPE-FUGYQKQMSA-N |
| Molecular Weight | 350.455 g/mol |
| SMILES | O[C@@](CC1([C@@]2([C@]3([C@@](CO)(CCC2)OC3)[C@](C[C@]1(C)[H])(O)[H])[H])C)(c1cocc1)[H] |
| SPLASH | splash10-00ks-7931000000-7b1c7a4d8b13394886b2 |
| Source of Spectrum | G4-61-1245-3 |
| Synonyms | 4.alpha.,19 : 15,16-Diepoxyneocleroda-1(16),14-diene-6.alpha.,12,18-triol |
| Wiley ID | 1607463 |