| SpectraBase Compound ID | HqUZ35ixQoZ |
|---|---|
| InChI | InChI=1S/C30H50O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-26-29(7)20-19-27(31)28(5,6)25(29)18-21-30(26,8)32/h12,14,16,25-26,32H,9-11,13,15,17-21H2,1-8H3/b23-14+,24-16+/t25?,26-,29+,30+/m1/s1 |
| InChIKey | CISVDYPCZUPOCT-CDFDSUPOSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C30H50O2 |
| Exact Mass | 442.381081 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Sk26v6usgK |
|---|---|
| Name | (8R)-3-OXO-8-HYDROXYPOLYPODA-13E,17E,21-TRIENE |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O2 |
| InChI | InChI=1S/C30H50O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-26-29(7)20-19-27(31)28(5,6)25(29)18-21-30(26,8)32/h12,14,16,25-26,32H,9-11,13,15,17-21H2,1-8H3/b23-14+,24-16+/t25?,26-,29+,30+/m1/s1 |
| InChIKey | CISVDYPCZUPOCT-CDFDSUPOSA-N |
| Literature Reference Author | F.J.MARNER,A.FREYER,J.LEX |
| Literature Reference Citation | PHYTOCHEM.,30,3709(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)80095-I |
| Molecular Weight | 442.726 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS27047 |