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.beta.-D-Glucopyranoside, methyl 4-O-(3,6-di-O-benzoyl-.beta.-D-galactopyranosyl)-
SpectraBase Compound ID 9HJNhruK916
InChI InChI=1S/C27H32O13/c1-35-26-20(31)19(30)22(16(12-28)37-26)40-27-21(32)23(39-25(34)15-10-6-3-7-11-15)18(29)17(38-27)13-36-24(33)14-8-4-2-5-9-14/h2-11,16-23,26-32H,12-13H2,1H3/t16-,17-,18+,19-,20-,21-,22-,23+,26-,27+/m1/s1
InChIKey QSIGNTSJEZZORL-BFFXKSFNSA-N
Mol Weight 564.5 g/mol
Molecular Formula C27H32O13
Exact Mass 564.184291 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lou9RqfL4E4
Name .beta.-D-Glucopyranoside, methyl 4-O-(3,6-di-O-benzoyl-.beta.-D-galactopyranosyl)-
Alternate Name(s) Methyl 4-O-(3,6-di-O-benzoyl-.beta.-D-galactopyranosyl)-.beta.-D-glucopyranoside
CAS Registry Number 65615-71-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32O13
InChI InChI=1S/C27H32O13/c1-35-26-20(31)19(30)22(16(12-28)37-26)40-27-21(32)23(39-25(34)15-10-6-3-7-11-15)18(29)17(38-27)13-36-24(33)14-8-4-2-5-9-14/h2-11,16-23,26-32H,12-13H2,1H3/t16-,17-,18+,19-,20-,21-,22-,23+,26-,27+/m1/s1
InChIKey QSIGNTSJEZZORL-BFFXKSFNSA-N
Molecular Weight 564.540 g/mol
SMILES O[C@]1([C@@](O[C@@]([C@]([C@@]1(O)[H])(O[C@]1([C@@]([C@]([C@]([C@](O1)(COC(=O)c1ccccc1)[H])(O)[H])(OC(=O)c1ccccc1)[H])(O)[H])[H])[H])(CO)[H])(OC)[H])[H]
SPLASH splash10-0v4i-1191000000-6658cfe81652e4ff3455
Source of Spectrum KC-1977-18-2004
Wiley ID 1407094