| SpectraBase Compound ID | H0IIBRFCw6u |
|---|---|
| InChI | InChI=1S/C27H29Br4N3O9/c1-13(35)33-12-21(41-14(2)36)16-8-17(28)23(18(29)9-16)40-7-5-6-32-26(38)20-11-27(43-34-20)10-19(30)24(39-4)22(31)25(27)42-15(3)37/h8-10,21,25H,5-7,11-12H2,1-4H3,(H,32,38)(H,33,35)/t21?,25-,27+/m0/s1 |
| InChIKey | YTJKYJHXWGIULA-DCRAVRKTSA-N |
| Mol Weight | 859.16 g/mol |
| Molecular Formula | C27H29Br4N3O9 |
| Exact Mass | 854.863732 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kil6NoBbzWb |
|---|---|
| Name | APLYSINAMISINE-3,DIACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H29Br4N3O9 |
| InChI | InChI=1S/C27H29Br4N3O9/c1-13(35)33-12-21(41-14(2)36)16-8-17(28)23(18(29)9-16)40-7-5-6-32-26(38)20-11-27(43-34-20)10-19(30)24(39-4)22(31)25(27)42-15(3)37/h8-10,21,25H,5-7,11-12H2,1-4H3,(H,32,38)(H,33,35)/t21?,25-,27+/m0/s1 |
| InChIKey | YTJKYJHXWGIULA-DCRAVRKTSA-N |
| Literature Reference Author | A.D.RODRIGUEZ,I.C.PINA |
| Literature Reference Citation | J.NAT.PROD.,56,907(1993) |
| Literature Reference DOI | 10.1021/np50096a014 |
| Molecular Weight | 859.158 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS3250 |