| SpectraBase Compound ID | 3txISuA6Asy |
|---|---|
| InChI | InChI=1S/C31H55O29P.2C6H15N/c1-50-27-19(43)17(41)23(10(5-35)55-27)57-31-22(46)26(15(39)11(56-31)6-51-61(47,48)49)60-30-21(45)25(14(38)9(4-34)54-30)59-29-20(44)24(13(37)8(3-33)53-29)58-28-18(42)16(40)12(36)7(2-32)52-28;2*1-4-7(5-2)6-3/h7-46H,2-6H2,1H3,(H2,47,48,49);2*4-6H2,1-3H3/t7-,8-,9-,10+,11-,12+,13+,14+,15+,16+,17+,18-,19-,20-,21-,22-,23+,24+,25+,26+,27-,28+,29+,30+,31+;;/m1../s1 |
| InChIKey | SVYCJESCVMXFIR-WSKXIFAESA-N |
| Mol Weight | 1125.11 g/mol |
| Molecular Formula | C43H85N2O29P |
| Exact Mass | 1124.497562 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LWoA4uebwHn |
|---|---|
| Name | METHYL-BETA-D-GALACTOPYRANOSYL-(1->3)-BETA-D-GALACTOPYRANOSYL-(1->3)-D-GALACTOPYRANOSYL-(1->3)-BETA-D-GALACTOPYRANOSYL-6-PHOSPHATE)-(1->4)-ALPHA-D- |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H85N2O29P |
| InChI | InChI=1S/C31H55O29P.2C6H15N/c1-50-27-19(43)17(41)23(10(5-35)55-27)57-31-22(46)26(15(39)11(56-31)6-51-61(47,48)49)60-30-21(45)25(14(38)9(4-34)54-30)59-29-20(44)24(13(37)8(3-33)53-29)58-28-18(42)16(40)12(36)7(2-32)52-28;2*1-4-7(5-2)6-3/h7-46H,2-6H2,1H3,(H2,47,48,49);2*4-6H2,1-3H3/t7-,8-,9-,10+,11-,12+,13+,14+,15+,16+,17+,18-,19-,20-,21-,22-,23+,24+,25+,26+,27-,28+,29+,30+,31+;;/m1../s1 |
| InChIKey | SVYCJESCVMXFIR-WSKXIFAESA-N |
| Literature Reference Author | A.V.NIKOLAEV,G.M.WATT,M.A.J.FERGUSON,J.S.BRIMACOMBE |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,969(1997) |
| Literature Reference DOI | 10.1039/a603800j |
| Molecular Weight | 1125.118 g/mol |
| Solvent | D2O |