| SpectraBase Compound ID | FhsS3fqtzyH |
|---|---|
| InChI | InChI=1S/C23H24Br4N4O9/c24-10-4-22(18(35)14(26)16(10)33)6-12(30-39-22)20(37)28-3-1-2-9(32)8-29-21(38)13-7-23(40-31-13)5-11(25)17(34)15(27)19(23)36/h4-5,9,14-15,18-19,32,35-36H,1-3,6-8H2,(H,28,37)(H,29,38)/t9?,14-,15-,18+,19+,22-,23-/m1/s1 |
| InChIKey | ZUZUYYDOVBLPEG-ZWKFVGJHSA-N |
| Mol Weight | 820.08 g/mol |
| Molecular Formula | C23H24Br4N4O9 |
| Exact Mass | 815.82768 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KOPG5EpJN0A |
|---|---|
| Name | AGELOCAISSARINE-B1 |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H24Br4N4O9 |
| InChI | InChI=1S/C23H24Br4N4O9/c24-10-4-22(18(35)14(26)16(10)33)6-12(30-39-22)20(37)28-3-1-2-9(32)8-29-21(38)13-7-23(40-31-13)5-11(25)17(34)15(27)19(23)36/h4-5,9,14-15,18-19,32,35-36H,1-3,6-8H2,(H,28,37)(H,29,38)/t9?,14-,15-,18+,19+,22-,23-/m1/s1 |
| InChIKey | ZUZUYYDOVBLPEG-ZWKFVGJHSA-N |
| Literature Reference Author | T.O.D.LIRA,R.G.S.BERLINCK,G.G.F.NASCIMENTO,E.HAJDU |
| Literature Reference Citation | J.BRAZ.CHEM.SOC.,17,1233(2006) |
| Molecular Weight | 820.081 g/mol |
| Source File Reference | UWIR5029 |