| SpectraBase Compound ID | CtqrjMVRWPz |
|---|---|
| InChI | InChI=1S/C22H41O14P.C6H15N/c1-2-3-4-5-6-7-8-9-10-32-37(30,31)36-22-19(29)17(27)20(14(12-24)34-22)35-21-18(28)16(26)15(25)13(11-23)33-21;1-4-7(5-2)6-3/h2,13-29H,1,3-12H2,(H,30,31);4-6H2,1-3H3/t13-,14-,15+,16+,17-,18-,19+,20-,21+,22-;/m1./s1 |
| InChIKey | JITBWEXUNUVAKV-VVBGVTPXSA-N |
| Mol Weight | 661.7 g/mol |
| Molecular Formula | C28H56NO14P |
| Exact Mass | 661.343842 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Al8al3OxRI2 |
|---|---|
| Name | DEC-9-ENYL-BETA-D-GALACTOPYRANOSYL-(1->4)-ALPHA-D-MANNOPYRANOSYLPHOSPHATE-TRIETHYLAMMONIUM-SALT |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H56NO14P |
| InChI | InChI=1S/C22H41O14P.C6H15N/c1-2-3-4-5-6-7-8-9-10-32-37(30,31)36-22-19(29)17(27)20(14(12-24)34-22)35-21-18(28)16(26)15(25)13(11-23)33-21;1-4-7(5-2)6-3/h2,13-29H,1,3-12H2,(H,30,31);4-6H2,1-3H3/t13-,14-,15+,16+,17-,18-,19+,20-,21+,22-;/m1./s1 |
| InChIKey | JITBWEXUNUVAKV-VVBGVTPXSA-N |
| Literature Reference Author | A.V.NIKOLAEV,T.J.RUTHERFORD,M.A.J.FERGUSON,J.S.BRIMACOMBE |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,1559(1996) |
| Literature Reference DOI | 10.1039/p19960001559 |
| Molecular Weight | 661.725 g/mol |
| Solvent | D2O |