| SpectraBase Compound ID | GPUUvb0BGtr |
|---|---|
| InChI | InChI=1S/C21H23Br4N3O6/c1-31-17-14(24)9-21(33-10-15(17)25)19(29)16(28-34-21)20(30)27-5-2-6-32-18-12(22)7-11(3-4-26)8-13(18)23/h7-8,10,19,29H,2-6,9,26H2,1H3,(H,27,30)/t19-,21-/m1/s1 |
| InChIKey | XVHHFAJHWSIGJS-TZIWHRDSSA-N |
| Mol Weight | 733.05 g/mol |
| Molecular Formula | C21H23Br4N3O6 |
| Exact Mass | 728.832037 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1BwyU8hBL8 |
|---|---|
| Name | PSAMMAPLYSIN |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H23Br4N3O6 |
| InChI | InChI=1S/C21H23Br4N3O6/c1-31-17-14(24)9-21(33-10-15(17)25)19(29)16(28-34-21)20(30)27-5-2-6-32-18-12(22)7-11(3-4-26)8-13(18)23/h7-8,10,19,29H,2-6,9,26H2,1H3,(H,27,30)/t19-,21-/m1/s1 |
| InChIKey | XVHHFAJHWSIGJS-TZIWHRDSSA-N |
| Literature Reference Author | M.R.KERNAN,R.C.CAMBIE,P.R.BERGQUIST |
| Literature Reference Citation | J.NAT.PROD.,53,615(1990) |
| Literature Reference DOI | 10.1021/np50069a012 |
| Molecular Weight | 733.046 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU288 |