![CEREBROSIDE;1-O-BETA-D-GLUCOPYRANOSYL-(2S*,3R*,4E,8Z)-2N-[(2R)-HYDROXYTETRACOSANOYL]-OCTADECASPHINGA-4,8-DIENINE](/api/spectrum/3wYxvyxX3LE/structure.png?h=300&w=458 "CEREBROSIDE;1-O-BETA-D-GLUCOPYRANOSYL-(2S*,3R*,4E,8Z)-2N-[(2R)-HYDROXYTETRACOSANOYL]-OCTADECASPHINGA-4,8-DIENINE")
| SpectraBase Compound ID | LCLsDAaIYVk |
|---|---|
| InChI | InChI=1S/C48H91NO9/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-42(52)47(56)49-40(39-57-48-46(55)45(54)44(53)43(38-50)58-48)41(51)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h26,28,34,36,40-46,48,50-55H,3-25,27,29-33,35,37-39H2,1-2H3,(H,49,56)/b28-26-,36-34+/t40-,41-,42+,43-,44-,45+,46-,48-/m0/s1 |
| InChIKey | WJKBJBJBUDIMHM-YFOZPEJFSA-N |
| Mol Weight | 826.3 g/mol |
| Molecular Formula | C48H91NO9 |
| Exact Mass | 825.669384 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3wYxvyxX3LE |
|---|---|
| Name | CEREBROSIDE;1-O-BETA-D-GLUCOPYRANOSYL-(2S*,3R*,4E,8Z)-2N-[(2R)-HYDROXYTETRACOSANOYL]-OCTADECASPHINGA-4,8-DIENINE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H91NO9 |
| InChI | InChI=1S/C48H91NO9/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-42(52)47(56)49-40(39-57-48-46(55)45(54)44(53)43(38-50)58-48)41(51)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h26,28,34,36,40-46,48,50-55H,3-25,27,29-33,35,37-39H2,1-2H3,(H,49,56)/b28-26-,36-34+/t40-,41-,42+,43-,44-,45+,46-,48-/m0/s1 |
| InChIKey | WJKBJBJBUDIMHM-YFOZPEJFSA-N |
| Literature Reference Author | H.LIU,J.ORJALA,T.RALI,O.STICHER |
| Literature Reference Citation | PHYTOCHEM.,49,2403(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00352-5 |
| Molecular Weight | 826.252 g/mol |
| Solvent | C5D5N |