| SpectraBase Compound ID | 8mie6wBrweF |
|---|---|
| InChI | InChI=1S/C31H45NO5/c1-17-14-24-28(32(16-17)13-10-25(34)36-5)19(3)31(37-24)12-9-22-23-7-6-20-15-21(33)8-11-30(20,4)27(23)29(35)26(22)18(31)2/h6,17,19,21-24,27-28,33H,7-16H2,1-5H3/t17-,19+,21-,22?,23?,24+,27+,28-,30-,31-/m0/s1 |
| InChIKey | MXDPCHQGAQFRMD-WOFPYYFWSA-N |
| Mol Weight | 511.7 g/mol |
| Molecular Formula | C31H45NO5 |
| Exact Mass | 511.329774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1odaTYFSHN2 |
|---|---|
| Name | METHYLJERVINE-N-3'-PROPANOATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H45NO5 |
| InChI | InChI=1S/C31H45NO5/c1-17-14-24-28(32(16-17)13-10-25(34)36-5)19(3)31(37-24)12-9-22-23-7-6-20-15-21(33)8-11-30(20,4)27(23)29(35)26(22)18(31)2/h6,17,19,21-24,27-28,33H,7-16H2,1-5H3/t17-,19+,21-,22?,23?,24+,27+,28-,30-,31-/m0/s1 |
| InChIKey | MXDPCHQGAQFRMD-WOFPYYFWSA-N |
| Literature Reference Author | A.U.RAHMAN,R.A.ALI,T.PARVEEN,M.I.CHOUDHARY,B.SENER,S.TURKOZ |
| Literature Reference Citation | PHYTOCHEM.,30,368(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)84161-K |
| Molecular Weight | 511.702 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWKP6608 |