| SpectraBase Compound ID | 7U1CA9aE8kU |
|---|---|
| InChI | InChI=1S/C22H35NO5/c1-3-23-9-20(10-24)5-4-16(25)22-12-6-11-14(28-2)8-21(27,17(12)18(11)26)13(19(22)23)7-15(20)22/h11-19,24-27H,3-10H2,1-2H3/t11-,12?,13+,14+,15?,16+,17?,18+,19-,20+,21+,22-/m1/s1 |
| InChIKey | VGMSYPBIRZMVCJ-ZSXQYPCHSA-N |
| Mol Weight | 393.5 g/mol |
| Molecular Formula | C22H35NO5 |
| Exact Mass | 393.251523 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 70sphmK0seG |
|---|---|
| Name | COLUMBIANINE |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H35NO5 |
| InChI | InChI=1S/C22H35NO5/c1-3-23-9-20(10-24)5-4-16(25)22-12-6-11-14(28-2)8-21(27,17(12)18(11)26)13(19(22)23)7-15(20)22/h11-19,24-27H,3-10H2,1-2H3/t11-,12?,13+,14+,15?,16+,17?,18+,19-,20+,21+,22-/m1/s1 |
| InChIKey | VGMSYPBIRZMVCJ-ZSXQYPCHSA-N |
| Literature Reference Author | J.B.HANUMAN,A.KATZ |
| Literature Reference Citation | PHYTOCHEM.,36,1527(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89756-3 |
| Molecular Weight | 393.524 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU26461 |