| SpectraBase Compound ID | 7MoSg80xc62 |
|---|---|
| InChI | InChI=1S/C42H83NO9/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-37(46)43-34(33-51-42-41(50)40(49)39(48)36(32-44)52-42)38(47)35(45)30-28-26-24-22-20-16-14-12-10-8-6-4-2/h34-36,38-42,44-45,47-50H,3-33H2,1-2H3,(H,43,46)/t34?,35?,36-,38?,39+,40+,41-,42-/m0/s1 |
| InChIKey | LZIKXVCJCBFOPY-FTJBPDACSA-N |
| Mol Weight | 746.1 g/mol |
| Molecular Formula | C42H83NO9 |
| Exact Mass | 745.606783 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K1DBIldHkR3 |
|---|---|
| Name | CEREBROSIDE-B |
| Compound Number | 4-B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H83NO9 |
| InChI | InChI=1S/C42H83NO9/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-37(46)43-34(33-51-42-41(50)40(49)39(48)36(32-44)52-42)38(47)35(45)30-28-26-24-22-20-16-14-12-10-8-6-4-2/h34-36,38-42,44-45,47-50H,3-33H2,1-2H3,(H,43,46)/t34?,35?,36-,38?,39+,40+,41-,42-/m0/s1 |
| InChIKey | LZIKXVCJCBFOPY-FTJBPDACSA-N |
| Literature Reference Author | P.L.SELMAIR,P.KOEHLER |
| Literature Reference Citation | J.AGR.FOOD.CHEM.,57,5597(2009) |
| Literature Reference DOI | 10.1021/jf9008982 |
| Molecular Weight | 746.122 g/mol |
| Sample ID | 41788 |
| Solvent | DMSO-D6 |