| SpectraBase Compound ID | 1Eia7rSeTJp |
|---|---|
| InChI | InChI=1S/C20H32O4/c1-7-19(5)16(23)14(22)15-18(4)10-9-13(21)17(2,3)12(18)8-11-20(15,6)24-19/h7,12,14-16,22-23H,1,8-11H2,2-6H3/t12?,14-,15?,16-,18+,19-,20-/m0/s1 |
| InChIKey | REQWBRZXRQZHMV-RQJRMBRQSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C20H32O4 |
| Exact Mass | 336.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LhiHy86OFqd |
|---|---|
| Name | ent-11.alpha.,12.alpha.-Dihydroxy-3-oxo-13-ep-manoyl oxide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.230059506 u |
| Formula | C20H32O4 |
| InChI | InChI=1S/C20H32O4/c1-7-19(5)16(23)14(22)15-18(4)10-9-13(21)17(2,3)12(18)8-11-20(15,6)24-19/h7,12,14-16,22-23H,1,8-11H2,2-6H3/t12?,14-,15?,16-,18+,19-,20-/m0/s1 |
| InChIKey | REQWBRZXRQZHMV-RQJRMBRQSA-N |
| Molecular Weight | 336.472 g/mol |
| SMILES | [C@@]12(C3[C@](O[C@]([C@]([C@]3(O)[H])(O)[H])(C=C)C)(C)CCC1C(C)(C)C(CC2)=O)C |