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Peracetoxy-B(1-3),B(1-6)-triglucose
SpectraBase Compound ID 8kiwXIBnlC8
InChI InChI=1S/C40H54O27/c1-15(41)52-12-26-31(57-19(5)45)34(67-40-37(62-24(10)50)33(59-21(7)47)29(55-17(3)43)27(66-40)13-53-16(2)42)35(60-22(8)48)38(64-26)54-14-28-30(56-18(4)44)32(58-20(6)46)36(61-23(9)49)39(65-28)63-25(11)51/h26-40H,12-14H2,1-11H3
InChIKey OVVXKFXWUZZSFC-UHFFFAOYSA-N
Mol Weight 966.8 g/mol
Molecular Formula C40H54O27
Exact Mass 966.285246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5SZmn6bg5Mf
Name .beta.-D-Glucopyranose, O-2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranosyl-(1.fwdarw.3)-O-2,4,6 -tri-O-acetyl-.beta.-D-glucopyranosyl-(1.fwdarw.6)-, tetraacetate
CAS Registry Number 89367-11-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H54O27
InChI InChI=1S/C40H54O27/c1-15(41)52-12-26-31(57-19(5)45)34(67-40-37(62-24(10)50)33(59-21(7)47)29(55-17(3)43)27(66-40)13-53-16(2)42)35(60-22(8)48)38(64-26)54-14-28-30(56-18(4)44)32(58-20(6)46)36(61-23(9)49)39(65-28)63-25(11)51/h26-40H,12-14H2,1-11H3
InChIKey OVVXKFXWUZZSFC-UHFFFAOYSA-N
Molecular Weight 966.845 g/mol
SMILES C1(C(C(OCC2C(C(OC(=O)C)C(C(O2)OC(=O)C)OC(=O)C)OC(=O)C)OC(C1OC(=O)C)COC(=O)C)OC(=O)C)OC1C(C(OC(=O)C)C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C
SPLASH splash10-0006-9200000000-ca1f68d1c160ba5ac1f5
Source of Spectrum H-67-385-0
Synonyms O-(2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranosyl)-(1-3)-O-(2,4,6-tri-O-acetyl-.beta.-D-glucopyranosyl)-(1-6)-1,2,3,4-tetra-O-acetyl-.beta.-D-glucopyranose [3,5-bis(acetyloxy)-6-{[3,4,5,6-tetrakis(acetyloxy)oxan-2-yl]methoxy}-4-{[3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}oxan-2-yl]methyl acetate
Wiley ID 1418296