| SpectraBase Compound ID | JTZWDYbbxBF |
|---|---|
| InChI | InChI=1S/C20H32O3/c1-13(2)16-11-18(22)15(4)10-17(21)9-14(3)7-6-8-20(5)19(12-16)23-20/h7,10,16-19,21-22H,1,6,8-9,11-12H2,2-5H3/b14-7+,15-10+/t16-,17-,18+,19-,20-/m1/s1 |
| InChIKey | QMHNJIBUSLNSHK-HOMHHWFXSA-N |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C20H32O3 |
| Exact Mass | 320.235145 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IpqqRNpPmJQ |
|---|---|
| Name | Cleospinol B |
| Appearance | oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H32O3 |
| InChI | InChI=1S/C20H32O3/c1-13(2)16-11-18(22)15(4)10-17(21)9-14(3)7-6-8-20(5)19(12-16)23-20/h7,10,16-19,21-22H,1,6,8-9,11-12H2,2-5H3/b14-7+,15-10+/t16-,17-,18+,19-,20-/m1/s1 |
| InChIKey | QMHNJIBUSLNSHK-HOMHHWFXSA-N |
| Instrument Name | VG 70-250S |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np0303299 |
| Molecular Weight | 320.473 g/mol |
| Optical Rotation | [a]D25 = +51.3 (c = 18.0, CHCl3) |
| Reported Formula | C20H32O3 |
| SMILES | O[C@@]1(C\C(=C\CC[C@@]2([C@@](C[C@@](C[C@@](\C(=C\1)C)(O)[H])(C(C)=C)[H])(O2)[H])C)C)[H] |
| SPLASH | splash10-007n-9813000000-a608714fa3fdfa6187a9 |
| Source of Spectrum | G4-67-182-3 |
| Wiley ID | 1881649 |