| SpectraBase Compound ID | AzISrntKb3Y |
|---|---|
| InChI | InChI=1S/C31H33NO7/c1-14-10-30-11-18-24-29(4)12-19(37-15(2)33)27(38-16(3)34)31(24)25(30)23(39-28(36)17-8-6-5-7-9-17)20(14)22(35)21(30)26(31)32(18)13-29/h5-9,18-21,23-27H,1,10-13H2,2-4H3/t18-,19-,20+,21?,23-,24+,25-,26?,27+,29+,30+,31-/m1/s1 |
| InChIKey | BISFSGRKAPWHGG-UJJPWQQLSA-N |
| Mol Weight | 531.6 g/mol |
| Molecular Formula | C31H33NO7 |
| Exact Mass | 531.225702 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Jt3PApzaEh |
|---|---|
| Name | 13-DEHYDROPANICULATINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H33NO7 |
| InChI | InChI=1S/C31H33NO7/c1-14-10-30-11-18-24-29(4)12-19(37-15(2)33)27(38-16(3)34)31(24)25(30)23(39-28(36)17-8-6-5-7-9-17)20(14)22(35)21(30)26(31)32(18)13-29/h5-9,18-21,23-27H,1,10-13H2,2-4H3/t18-,19-,20+,21?,23-,24+,25-,26?,27+,29+,30+,31-/m1/s1 |
| InChIKey | BISFSGRKAPWHGG-UJJPWQQLSA-N |
| Literature Reference Author | A.KATZ |
| Literature Reference Citation | J.NAT.PROD.,52,430(1989) |
| Literature Reference DOI | 10.1021/np50062a044 |
| Molecular Weight | 531.606 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS1124 |