| SpectraBase Compound ID | GLKUpQAQZwZ |
|---|---|
| InChI | InChI=1S/C26H31NO6/c1-31-24-12-18-19(13-25(24)32-2)21-11-17(10-16-5-3-4-8-27(16)21)33-26(30)14-23(29)15-6-7-22(28)20(18)9-15/h6-7,9,12-13,16-17,21,23,28-29H,3-5,8,10-11,14H2,1-2H3/t16-,17+,21+,23?/m1/s1 |
| InChIKey | AZYBQXPITOLDBL-QNADOQGOSA-N |
| Mol Weight | 453.54 g/mol |
| Molecular Formula | C26H31NO6 |
| Exact Mass | 453.215138 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HYyMmkCg4SC |
|---|---|
| Name | HEIMIDINE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H31NO6 |
| InChI | InChI=1S/C26H31NO6/c1-31-24-12-18-19(13-25(24)32-2)21-11-17(10-16-5-3-4-8-27(16)21)33-26(30)14-23(29)15-6-7-22(28)20(18)9-15/h6-7,9,12-13,16-17,21,23,28-29H,3-5,8,10-11,14H2,1-2H3/t16-,17+,21+,23?/m1/s1 |
| InChIKey | AZYBQXPITOLDBL-QNADOQGOSA-N |
| Literature Reference Author | C.S.RUMALLA,A.N.JADHAV,T.SMILLIE,F.R.FRONCZEK,I.A.KHAN |
| Literature Reference Citation | PHYTOCHEM.,69,1756(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.01.028 |
| Molecular Weight | 453.535 g/mol |
| Sample ID | 44143 |
| Solvent | CD3OD |