| SpectraBase Compound ID | KGWl7RQC8v9 |
|---|---|
| InChI | InChI=1S/C37H50N2O10/c1-7-38-17-34(18-49-32(42)20-10-8-9-11-23(20)39-26(40)14-19(2)31(39)41)13-12-25(46-4)36-22-15-21-24(45-3)16-35(43,27(22)28(21)47-5)37(44,33(36)38)30(48-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,43-44H,7,12-18H2,1-6H3/t19?,21-,22?,24-,25?,27?,28?,29+,30?,33-,34-,35-,36-,37+/m1/s1 |
| InChIKey | XLTANAWLDBYGFU-QHRBSVJHSA-N |
| Mol Weight | 682.8 g/mol |
| Molecular Formula | C37H50N2O10 |
| Exact Mass | 682.346546 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1u8GePEm9rU |
|---|---|
| Name | METHYLLYCACONITINE |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C37H50N2O10/c1-7-38-17-34(18-49-32(42)20-10-8-9-11-23(20)39-26(40)14-19(2)31(39)41)13-12-25(46-4)36-22-15-21-24(45-3)16-35(43,27(22)28(21)47-5)37(44,33(36)38)30(48-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,43-44H,7,12-18H2,1-6H3/t19?,21-,22?,24-,25?,27?,28?,29+,30?,33-,34-,35-,36-,37+/m1/s1 |
| InChIKey | XLTANAWLDBYGFU-QHRBSVJHSA-N |
| Literature Reference | S.W.PELLETIER,N.V.MODY,R.S.SAWHNEY,J.BHATTACHARYYA HETEROCYCLES,7,327(1977) |
| Solvent | Chloroform-d |