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2-O-Decyl-3,4,6-tri-O-acetyl-b-d-glucopyranose

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2-O-Decyl-3,4,6-tri-O-acetyl-b-d-glucopyranose
SpectraBase Compound ID FCxpM3WqdQX
InChI InChI=1S/C22H38O9/c1-5-6-7-8-9-10-11-12-13-27-21-20(30-17(4)25)19(29-16(3)24)18(31-22(21)26)14-28-15(2)23/h18-22,26H,5-14H2,1-4H3/t18-,19+,20-,21-,22+/m0/s1
InChIKey ZGNCMLNUXLLFPI-LILSUDLASA-N
Mol Weight 446.5 g/mol
Molecular Formula C22H38O9
Exact Mass 446.251583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9zerDBRPlTM
Name 2-o-Decyl-3,4,6-tri-o-acetyl-B-D-glucopyranose
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.251582795 u
Formula C22H38O9
InChI InChI=1S/C22H38O9/c1-5-6-7-8-9-10-11-12-13-27-21-20(30-17(4)25)19(29-16(3)24)18(31-22(21)26)14-28-15(2)23/h18-22,26H,5-14H2,1-4H3/t18-,19+,20-,21-,22+/m0/s1
InChIKey ZGNCMLNUXLLFPI-LILSUDLASA-N
Molecular Weight 446.537 g/mol
SMILES O[C@@]1(O[C@]([C@]([C@](OC(=O)C)([C@@]1(OCCCCCCCCCC)[H])[H])(OC(=O)C)[H])(COC(=O)C)[H])[H]