| SpectraBase Compound ID | KU1o5WHtZN9 |
|---|---|
| InChI | InChI=1S/C46H54N4O11/c1-7-29(54)20-28-23-45(41(55)59-5,37-31(14-18-48(24-28)25-51)30-12-9-10-13-34(30)47-37)33-21-32-35(22-36(33)58-4)50(26-52)39-44(32)16-19-49-17-11-15-43(8-2,38(44)49)40(61-27(3)53)46(39,57)42(56)60-6/h9-13,15,21-22,25-26,28,38-40,47,57H,7-8,14,16-20,23-24H2,1-6H3/t28-,38?,39+,40+,43+,44+,45+,46-/m0/s1 |
| InChIKey | DFUHOOBFVYTEFW-PPLJXRPESA-N |
| Mol Weight | 839.0 g/mol |
| Molecular Formula | C46H54N4O11 |
| Exact Mass | 838.378909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FXjvFxhAqPG |
|---|---|
| Name | N-FORMYLCATHARININE;ISOMER_2 |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H54N4O11 |
| InChI | InChI=1S/C46H54N4O11/c1-7-29(54)20-28-23-45(41(55)59-5,37-31(14-18-48(24-28)25-51)30-12-9-10-13-34(30)47-37)33-21-32-35(22-36(33)58-4)50(26-52)39-44(32)16-19-49-17-11-15-43(8-2,38(44)49)40(61-27(3)53)46(39,57)42(56)60-6/h9-13,15,21-22,25-26,28,38-40,47,57H,7-8,14,16-20,23-24H2,1-6H3/t28-,38?,39+,40+,43+,44+,45+,46-/m0/s1 |
| InChIKey | DFUHOOBFVYTEFW-PPLJXRPESA-N |
| Literature Reference Author | S.H.AHN,M.W.DUFFEL,J.P.N.ROSAZZA |
| Literature Reference Citation | J.NAT.PROD.,60,1125(1997) |
| Literature Reference DOI | 10.1021/np970226o |
| Molecular Weight | 838.955 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ10823 |