| SpectraBase Compound ID | GWCrqXaerDn |
|---|---|
| InChI | InChI=1S/C22H22Br4N10O2/c23-9-2-12(32-17(9)25)19(37)29-4-7-1-11-16(36-22(28)34-11)15(14-6-31-21(27)35-14)8(7)5-30-20(38)13-3-10(24)18(26)33-13/h2-3,6-8,15,32-33H,1,4-5H2,(H,29,37)(H,30,38)(H3,27,31,35)(H3,28,34,36)/t7-,8-,15+/m1/s1 |
| InChIKey | VOGBZMFIZJPYAJ-PISXGGPESA-N |
| Mol Weight | 778.1 g/mol |
| Molecular Formula | C22H22Br4N10O2 |
| Exact Mass | 773.866072 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I481J1Vp8zh |
|---|---|
| Name | NAGELAMIDE_G |
| CAS Registry Number | 690627-60-2 |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H22Br4N10O2 |
| InChI | InChI=1S/C22H22Br4N10O2/c23-9-2-12(32-17(9)25)19(37)29-4-7-1-11-16(36-22(28)34-11)15(14-6-31-21(27)35-14)8(7)5-30-20(38)13-3-10(24)18(26)33-13/h2-3,6-8,15,32-33H,1,4-5H2,(H,29,37)(H,30,38)(H3,27,31,35)(H3,28,34,36)/t7-,8-,15+/m1/s1 |
| InChIKey | VOGBZMFIZJPYAJ-PISXGGPESA-N |
| Literature Reference Author | T.ENDO,M.TSUDA,T.OKADA,S.MITSUHASHI,H.SHIMA,K.KIKUCHI,Y.MIKA MI,J.FROMONT,J.I.KOB |
| Literature Reference Citation | J.NAT.PROD.,67,1262(2004) |
| Literature Reference DOI | 10.1021/np034077n |
| Molecular Weight | 778.098 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ7302 |