| SpectraBase Compound ID | EuPEG7qaanI |
|---|---|
| InChI | InChI=1S/C40H48N4O2/c1-3-37-13-6-18-42-20-12-27-26-8-4-5-9-31(26)44(33(27)34(37)42)32(24-37)25-10-11-30-28(22-25)39-17-21-43-19-7-14-38(36(39)43)15-16-40(39,41-30)29(23-38)35(45)46-2/h4-5,8-11,22,29,32,34,36,41H,3,6-7,12-21,23-24H2,1-2H3/t29-,32+,34+,36-,37-,38+,39+,40+/m0/s1 |
| InChIKey | BIJHVDNGQCIFEQ-GXVLEKNJSA-N |
| Mol Weight | 616.9 g/mol |
| Molecular Formula | C40H48N4O2 |
| Exact Mass | 616.377727 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8laWTMs0oY3 |
|---|---|
| Name | (+)-KOPSOFFINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H48N4O2 |
| InChI | InChI=1S/C40H48N4O2/c1-3-37-13-6-18-42-20-12-27-26-8-4-5-9-31(26)44(33(27)34(37)42)32(24-37)25-10-11-30-28(22-25)39-17-21-43-19-7-14-38(36(39)43)15-16-40(39,41-30)29(23-38)35(45)46-2/h4-5,8-11,22,29,32,34,36,41H,3,6-7,12-21,23-24H2,1-2H3/t29-,32+,34+,36-,37-,38+,39+,40+/m0/s1 |
| InChIKey | BIJHVDNGQCIFEQ-GXVLEKNJSA-N |
| Literature Reference Author | X.Z.FENG,C.KAN,H.P.HUSSON,P.POTIER,S.K.KAN,M.LOUNASMAA |
| Literature Reference Citation | J.NAT.PROD.,47,117(1984) |
| Literature Reference DOI | 10.1021/np50031a016 |
| Molecular Weight | 616.847 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS3576 |