| SpectraBase Compound ID | 1tFcTAxfzdc |
|---|---|
| InChI | InChI=1S/C28H44O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26)15-16-28(23,24)31-30-27/h7-8,15-16,18-24,29H,9-14,17H2,1-6H3/b8-7+/t19-,20-,21+,22-,23-,24?,25-,26-,27-,28+/m1/s1 |
| InChIKey | VXOZCESVZIRHCJ-LAXGAHJVSA-N |
| Mol Weight | 428.7 g/mol |
| Molecular Formula | C28H44O3 |
| Exact Mass | 428.329045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4AOWQrPQL2H |
|---|---|
| Name | EGOSTEROLPEROXIDE;3-BETA-HYDROXY-5,8-EPIDIOXYERGOSTA-6,22-DIENE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H44O3 |
| InChI | InChI=1S/C28H44O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26)15-16-28(23,24)31-30-27/h7-8,15-16,18-24,29H,9-14,17H2,1-6H3/b8-7+/t19-,20-,21+,22-,23-,24?,25-,26-,27-,28+/m1/s1 |
| InChIKey | VXOZCESVZIRHCJ-LAXGAHJVSA-N |
| Literature Reference Author | Y.TAKAISHI,M.UDA,T.OHASHI,K.NAKANO,K.MURAKAMI,T.TOMIMATSU |
| Literature Reference Citation | PHYTOCHEM.,30,4117(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83478-4 |
| Molecular Weight | 428.656 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU28265 |