| SpectraBase Compound ID | LJqqSvcblv6 |
|---|---|
| InChI | InChI=1S/C21H25ClN4O7/c1-9-12(22)5-14-15(16(9)28)11(6-26(14)4)18-25-21(3,8-33-18)20(32)23-10(2)17(29)24-13(7-27)19(30)31/h5-6,10,13,27-28H,7-8H2,1-4H3,(H,23,32)(H,24,29)(H,30,31)/t10-,13+,21-/m1/s1 |
| InChIKey | OTAMFIXIIUUMKV-JGMWFTNYSA-N |
| Mol Weight | 480.91 g/mol |
| Molecular Formula | C21H25ClN4O7 |
| Exact Mass | 480.141177 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HjHxKwlVB1o |
|---|---|
| Name | JBIR-34 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H25ClN4O7 |
| InChI | InChI=1S/C21H25ClN4O7/c1-9-12(22)5-14-15(16(9)28)11(6-26(14)4)18-25-21(3,8-33-18)20(32)23-10(2)17(29)24-13(7-27)19(30)31/h5-6,10,13,27-28H,7-8H2,1-4H3,(H,23,32)(H,24,29)(H,30,31)/t10-,13+,21-/m1/s1 |
| InChIKey | OTAMFIXIIUUMKV-JGMWFTNYSA-N |
| Literature Reference Author | K.MOTOHASHI,M.TAKAGI,K.SHIN-YA |
| Literature Reference Citation | J.NAT.PROD.,73,226(2010) |
| Literature Reference DOI | 10.1021/np900810r |
| Molecular Weight | 480.905 g/mol |
| Sample ID | 34476 |
| Solvent | DMSO-D6 |