| SpectraBase Compound ID | 5Fr2AxPALKp |
|---|---|
| InChI | InChI=1S/C25H40O3/c1-16(8-11-22(27)28-4)18-9-10-19-23-20(12-14-25(18,19)3)24(2)13-6-5-7-17(24)15-21(23)26/h5,7,16-21,23,26H,6,8-15H2,1-4H3/t16-,17+,18-,19+,20+,21-,23+,24+,25-/m1/s1 |
| InChIKey | MSIWHMSKXNHUNI-IGANSQQNSA-N |
| Mol Weight | 388.6 g/mol |
| Molecular Formula | C25H40O3 |
| Exact Mass | 388.297745 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IdE4LMAPLPj |
|---|---|
| Name | 7-HYDROXY-METHYL-5-BETA-CHOL-3-ENOATE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H40O3 |
| InChI | InChI=1S/C25H40O3/c1-16(8-11-22(27)28-4)18-9-10-19-23-20(12-14-25(18,19)3)24(2)13-6-5-7-17(24)15-21(23)26/h5,7,16-21,23,26H,6,8-15H2,1-4H3/t16-,17+,18-,19+,20+,21-,23+,24+,25-/m1/s1 |
| InChIKey | MSIWHMSKXNHUNI-IGANSQQNSA-N |
| Literature Reference Author | T.IIDA,J.GOTO,T.NAMBARA |
| Literature Reference Citation | MAGN.RES.CHEM.,31,421(1993) |
| Literature Reference DOI | 10.1002/mrc.1260310423 |
| Molecular Weight | 388.591 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMR163 |