| SpectraBase Compound ID | DBZfcXiZGtn |
|---|---|
| InChI | InChI=1S/C24H26Br4N4O8/c1-38-18-12(26)8-24(20(35)16(18)28)10-14(32-40-24)22(37)30-6-4-2-3-5-29-21(36)13-9-23(39-31-13)7-11(25)17(33)15(27)19(23)34/h7-8,15,19-20,34-35H,2-6,9-10H2,1H3,(H,29,36)(H,30,37)/t15-,19+,20+,23-,24-/m1/s1 |
| InChIKey | KCVKPVRAUSPLPZ-CPXJRIKISA-N |
| Mol Weight | 818.11 g/mol |
| Molecular Formula | C24H26Br4N4O8 |
| Exact Mass | 813.848416 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3Mduhd8JZr1 |
|---|---|
| Name | APLYSINONE-A |
| Compound Number | 54 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H26Br4N4O8 |
| InChI | InChI=1S/C24H26Br4N4O8/c1-38-18-12(26)8-24(20(35)16(18)28)10-14(32-40-24)22(37)30-6-4-2-3-5-29-21(36)13-9-23(39-31-13)7-11(25)17(33)15(27)19(23)34/h7-8,15,19-20,34-35H,2-6,9-10H2,1H3,(H,29,36)(H,30,37)/t15-,19+,20+,23-,24-/m1/s1 |
| InChIKey | KCVKPVRAUSPLPZ-CPXJRIKISA-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 | 818.108 g/mol |
| Source File Reference | UWBT6924 |