| SpectraBase Compound ID | 5LHLO9U1PrH |
|---|---|
| InChI | InChI=1S/C15H21Br2N5O5/c1-26-11-8(16)4-15(12(24)10(11)17)5-9(22-27-15)13(25)21-6-7(23)2-3-20-14(18)19/h4,7,12,23-24H,2-3,5-6H2,1H3,(H,21,25)(H4,18,19,20)/t7?,12-,15+/m1/s1 |
| InChIKey | RXBVKUAAUFHYBW-APWBMBHSSA-N |
| Mol Weight | 511.17 g/mol |
| Molecular Formula | C15H21Br2N5O5 |
| Exact Mass | 508.990945 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JDJGuGpMoZb |
|---|---|
| Name | CAISSARINE-A |
| Compound Number | 79 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C15H21Br2N5O5 |
| InChI | InChI=1S/C15H21Br2N5O5/c1-26-11-8(16)4-15(12(24)10(11)17)5-9(22-27-15)13(25)21-6-7(23)2-3-20-14(18)19/h4,7,12,23-24H,2-3,5-6H2,1H3,(H,21,25)(H4,18,19,20)/t7?,12-,15+/m1/s1 |
| InChIKey | RXBVKUAAUFHYBW-APWBMBHSSA-N |
| Literature Reference Author | N.S.LIRA,R.C.MONTES,J.F.TAVARES,M.S.D.SILVA,E.V.L.D.CUNHA,P. F.D.ATHAYDE-FILHO |
| Literature Reference Citation | MAR.DRUGS,9,2316(2011) |
| Literature Reference DOI | 10.3390/md9112316 |
| Molecular Weight | 511.170 g/mol |
| Source File Reference | UWBT6945 |