| SpectraBase Compound ID | BqzgDwOdcxj |
|---|---|
| InChI | InChI=1S/C37H74N2O5S/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-36(40)35(34-44-45(42,43)33-32-38-3)39-37(41)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h28,30,35-36,38,40H,4-27,29,31-34H2,1-3H3,(H,39,41)/b30-28+/t35-,36+/m0/s1 |
| InChIKey | XHQJYAUMXQHXKF-PSALXKTOSA-N |
| Mol Weight | 659.1 g/mol |
| Molecular Formula | C37H74N2O5S |
| Exact Mass | 658.531845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9EPAfuijamC |
|---|---|
| Name | PALYOSULFONO-CERAMIDE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H74N2O5S |
| InChI | InChI=1S/C37H74N2O5S/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-36(40)35(34-44-45(42,43)33-32-38-3)39-37(41)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h28,30,35-36,38,40H,4-27,29,31-34H2,1-3H3,(H,39,41)/b30-28+/t35-,36+/m0/s1 |
| InChIKey | XHQJYAUMXQHXKF-PSALXKTOSA-N |
| Literature Reference Author | J.G.L.ALMEIDA,A.I.V.MAIA,D.V.WILKE,E.R.SILVEIRA,R.BRAZ-FILHO ,J.J.L.CLAIR |
| Literature Reference Citation | MAR.DRUGS,10,2846(2012) |
| Literature Reference DOI | 10.3390/md10122846 |
| Molecular Weight | 659.065 g/mol |
| Source File Reference | UWIR6091 |