| SpectraBase Compound ID | IeXXziiWhP6 |
|---|---|
| InChI | InChI=1S/C28H45NO7/c1-7-29-13-26(14-32-4)10-9-19(31)28-17-11-16-18(33-5)12-27(35-8-2,20(17)22(16)36-15(3)30)21(25(28)29)23(34-6)24(26)28/h16-25,31H,7-14H2,1-6H3/t16-,17-,18+,19-,20-,21+,22+,23+,24-,25-,26+,27-,28+/m1/s1 |
| InChIKey | WLMXUEXOPMHSFQ-OWGXSOQISA-N |
| Mol Weight | 507.7 g/mol |
| Molecular Formula | C28H45NO7 |
| Exact Mass | 507.319603 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6388NlDiCJp |
|---|---|
| Name | 8-O-ETHYL-14-ACETYL-1-EPI-NEOLINE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H45NO7 |
| InChI | InChI=1S/C28H45NO7/c1-7-29-13-26(14-32-4)10-9-19(31)28-17-11-16-18(33-5)12-27(35-8-2,20(17)22(16)36-15(3)30)21(25(28)29)23(34-6)24(26)28/h16-25,31H,7-14H2,1-6H3/t16-,17-,18+,19-,20-,21+,22+,23+,24-,25-,26+,27-,28+/m1/s1 |
| InChIKey | WLMXUEXOPMHSFQ-OWGXSOQISA-N |
| Literature Reference Author | S.W.PELLETIER,H.K.DESAI,Q.JIANG,S.A.ROSS |
| Literature Reference Citation | PHYTOCHEM.,29,3649(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85293-O |
| Molecular Weight | 507.668 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU26940 |