| SpectraBase Compound ID | 7UUQTquAD4L |
|---|---|
| InChI | InChI=1S/C21H34O3/c1-12(22)19-18(24)11-17-15-5-4-13-10-14(23)6-8-20(13,2)16(15)7-9-21(17,19)3/h4,12,14-19,22-24H,5-11H2,1-3H3/t12?,14-,15+,16-,17-,18-,19-,20-,21-/m0/s1 |
| InChIKey | BBYKCTWGEWBSOL-JKBZKTSESA-N |
| Mol Weight | 334.5 g/mol |
| Molecular Formula | C21H34O3 |
| Exact Mass | 334.250795 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lhq1eRDlYIS |
|---|---|
| Name | DELTA(5)-PREGNENE-3-BETA,16-ALPHA,20(S)-TRIOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H34O3 |
| InChI | InChI=1S/C21H34O3/c1-12(22)19-18(24)11-17-15-5-4-13-10-14(23)6-8-20(13,2)16(15)7-9-21(17,19)3/h4,12,14-19,22-24H,5-11H2,1-3H3/t12?,14-,15+,16-,17-,18-,19-,20-,21-/m0/s1 |
| InChIKey | BBYKCTWGEWBSOL-JKBZKTSESA-N |
| Literature Reference Author | H.ITOKAWA,J.XU,K.TAKEYA |
| Literature Reference Citation | PHYTOCHEM.,27,1173(1988) |
| Literature Reference DOI | 10.1016/0031-9422(88)80297-8 |
| Molecular Weight | 334.499 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK1399 |