| SpectraBase Compound ID | 4OeqBFTJKrs |
|---|---|
| InChI | InChI=1S/C37H40N2O6/c1-39-17-15-25-21-31(41-3)35(43-5)37-33(25)29(39)19-23-8-12-26(13-9-23)44-36-32-24(20-30(40-2)34(36)42-4)14-16-38-28(32)18-22-6-10-27(45-37)11-7-22/h6-13,20-21,28-29,38H,14-19H2,1-5H3/t28-,29-/m1/s1 |
| InChIKey | ZYKGNXPEWXZKGA-FQLXRVMXSA-N |
| Mol Weight | 608.7 g/mol |
| Molecular Formula | C37H40N2O6 |
| Exact Mass | 608.288637 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8XXWcCeHdMV |
|---|---|
| Name | N-DESMETHYL-CYCLEANINE |
| Compound Number | 233 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H40N2O6 |
| InChI | InChI=1S/C37H40N2O6/c1-39-17-15-25-21-31(41-3)35(43-5)37-33(25)29(39)19-23-8-12-26(13-9-23)44-36-32-24(20-30(40-2)34(36)42-4)14-16-38-28(32)18-22-6-10-27(45-37)11-7-22/h6-13,20-21,28-29,38H,14-19H2,1-5H3/t28-,29-/m1/s1 |
| InChIKey | ZYKGNXPEWXZKGA-FQLXRVMXSA-N |
| Literature Reference Author | P.L.SCHIFF |
| Literature Reference Citation | J.NAT.PROD.,50,529(1987) |
| Literature Reference DOI | 10.1021/np50052a001 |
| Molecular Weight | 608.734 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED17937 |