| SpectraBase Compound ID | 7XbogkEHTMR |
|---|---|
| InChI | InChI=1S/C31H50O6/c1-17-9-12-31(25(35)37-8)14-13-28(5)18(22(31)30(17,7)36)15-19(32)23-27(4)16-20(33)24(34)26(2,3)21(27)10-11-29(23,28)6/h15,17,19-24,32-34,36H,9-14,16H2,1-8H3/t17-,19-,20-,21+,22-,23-,24+,27+,28-,29-,30-,31+/m1/s1 |
| InChIKey | RFCWIDTZVWTUPH-FPLUOKDJSA-N |
| Mol Weight | 518.7 g/mol |
| Molecular Formula | C31H50O6 |
| Exact Mass | 518.360739 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FqK1hSGTwE7 |
|---|---|
| Name | METHYL-11-ALPHA-HYDROXYTORMENTATE |
| Compound Number | 5A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H50O6 |
| InChI | InChI=1S/C31H50O6/c1-17-9-12-31(25(35)37-8)14-13-28(5)18(22(31)30(17,7)36)15-19(32)23-27(4)16-20(33)24(34)26(2,3)21(27)10-11-29(23,28)6/h15,17,19-24,32-34,36H,9-14,16H2,1-8H3/t17-,19-,20-,21+,22-,23-,24+,27+,28-,29-,30-,31+/m1/s1 |
| InChIKey | RFCWIDTZVWTUPH-FPLUOKDJSA-N |
| Literature Reference Author | J.M.FANG,K.C.WANG,Y.S.CHENG |
| Literature Reference Citation | PHYTOCHEM.,30,3383(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83214-6 |
| Molecular Weight | 518.734 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI23326 |