| SpectraBase Compound ID | 7sMfPHM3PXM |
|---|---|
| InChI | InChI=1S/C31H54O26/c1-48-27-19(44)14(39)23(8(3-33)50-27)55-29-21(46)16(41)25(10(5-35)52-29)57-31-22(47)17(42)26(11(6-36)53-31)56-30-20(45)15(40)24(9(4-34)51-30)54-28-18(43)13(38)12(37)7(2-32)49-28/h7-47H,2-6H2,1H3/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-/m0/s1 |
| InChIKey | OIOVXVCYPGWYTP-HMCJBDLDSA-N |
| Mol Weight | 842.7 g/mol |
| Molecular Formula | C31H54O26 |
| Exact Mass | 842.290332 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GVSC2X9hsQo |
|---|---|
| Name | METHYL-BETA-D-CELLOPENTAOSE |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H54O26 |
| InChI | InChI=1S/C31H54O26/c1-48-27-19(44)14(39)23(8(3-33)50-27)55-29-21(46)16(41)25(10(5-35)52-29)57-31-22(47)17(42)26(11(6-36)53-31)56-30-20(45)15(40)24(9(4-34)51-30)54-28-18(43)13(38)12(37)7(2-32)49-28/h7-47H,2-6H2,1H3/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-/m0/s1 |
| InChIKey | OIOVXVCYPGWYTP-HMCJBDLDSA-N |
| Literature Reference Author | L.A.FLUGGE,J.T.BLANK,P.A.PETILLO |
| Literature Reference Citation | J.AM.CHEM.SOC.,121,7228(1999) |
| Literature Reference DOI | 10.1021/ja990561u |
| Molecular Weight | 842.754 g/mol |
| Solvent | D2O |
| Source File Reference | UWRU11448 |