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Methyl 3,6-di-O-acetyl-2,4-di-O-heptylhexopyranoside

View entire compound with spectra: 1 MS (GC)

Methyl 3,6-di-O-acetyl-2,4-di-O-heptylhexopyranoside
SpectraBase Compound ID KJfsmJjV2RO
InChI InChI=1S/C25H46O8/c1-6-8-10-12-14-16-29-22-21(18-31-19(3)26)33-25(28-5)24(23(22)32-20(4)27)30-17-15-13-11-9-7-2/h21-25H,6-18H2,1-5H3/t21-,22-,23+,24+,25+/m1/s1
InChIKey CDSGOWSRRIVCEJ-VAFBSOEGSA-N
Mol Weight 474.6 g/mol
Molecular Formula C25H46O8
Exact Mass 474.319268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 99RfSq5ZsAo
Name Methyl 3,6-di-O-acetyl-2,4-di-O-heptylhexopyranoside
Alternate Name(s) (4-acetoxy-3,5-diheptoxy-6-methoxy-tetrahydropyran-2-yl)methyl acetate (4-acetyloxy-3,5-diheptoxy-6-methoxy-oxan-2-yl)methyl ethanoate (4-acetyloxy-3,5-diheptoxy-6-methoxyoxan-2-yl)methyl acetate .alpha.-D-Mannopyranoside, methyl-3,6-di-O-acetyl-2,4-di-O-heptyl- Acetic acid (4-acetoxy-3,5-diheptoxy-6-methoxy-tetrahydropyran-2-yl)methyl ester Acetic acid (4-acetyloxy-3,5-diheptoxy-6-methoxy-2-oxanyl)methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H46O8
InChI InChI=1S/C25H46O8/c1-6-8-10-12-14-16-29-22-21(18-31-19(3)26)33-25(28-5)24(23(22)32-20(4)27)30-17-15-13-11-9-7-2/h21-25H,6-18H2,1-5H3/t21-,22-,23+,24+,25+/m1/s1
InChIKey CDSGOWSRRIVCEJ-VAFBSOEGSA-N
Molecular Weight 474.635 g/mol
SMILES CCCCCCCO[C@@]1([C@](O[C@@]([C@]([C@]1(OC(=O)C)[H])(OCCCCCCC)[H])(OC)[H])(COC(=O)C)[H])[H]
SPLASH splash10-0a4i-9850000000-2774898f58895ec5d875
Wiley ID 1497231