| SpectraBase Compound ID | 14obyqFYNgd |
|---|---|
| InChI | InChI=1S/C22H30N4O5/c1-13(27)24-18-9-5-16(6-10-18)12-20(22(30)31)26-21(29)19(25-14(2)28)11-15-3-7-17(23)8-4-15/h3,5,7,9,11-12,17-20H,4,6,8,10,23H2,1-2H3,(H,24,27)(H,25,28)(H,26,29)(H,30,31)/b15-11-,16-12+/t17-,18-,19+,20+/m0/s1 |
| InChIKey | ZKDJPRDXYUPPEK-LDMZWZPJSA-N |
| Mol Weight | 430.51 g/mol |
| Molecular Formula | C22H30N4O5 |
| Exact Mass | 430.22162 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A9JI4W9942J |
|---|---|
| Name | DEHYDRORADIOSUMIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H30N4O5 |
| InChI | InChI=1S/C22H30N4O5/c1-13(27)24-18-9-5-16(6-10-18)12-20(22(30)31)26-21(29)19(25-14(2)28)11-15-3-7-17(23)8-4-15/h3,5,7,9,11-12,17-20H,4,6,8,10,23H2,1-2H3,(H,24,27)(H,25,28)(H,26,29)(H,30,31)/b15-11-,16-12+/t17-,18-,19+,20+/m0/s1 |
| InChIKey | ZKDJPRDXYUPPEK-LDMZWZPJSA-N |
| Literature Reference Author | S.KODANI,K.ISHIDA,M.MURAKAMI |
| Literature Reference Citation | J.NAT.PROD.,61,854(1998) |
| Literature Reference DOI | 10.1021/np980048e |
| Molecular Weight | 430.504 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWKP140 |