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D-Glucopyranoside, methyl 3,4,6-tri-O-methyl-2-O-(2,3,4,6-tetra-O-methyl-.beta.-D-glucopyranos yl)-
SpectraBase Compound ID CiDN7IBadbK
InChI InChI=1S/C20H38O11/c1-21-9-11-14(24-4)16(26-6)18(19(28-8)29-11)31-20-17(27-7)15(25-5)13(23-3)12(30-20)10-22-2/h11-20H,9-10H2,1-8H3/t11-,12-,13-,14-,15+,16+,17-,18-,19?,20+/m1/s1
InChIKey JIBCAZMNXQQBIE-AOBLTQEASA-N
Mol Weight 454.5 g/mol
Molecular Formula C20H38O11
Exact Mass 454.241412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SsnjIWig6L
Name D-Glucopyranoside, methyl 3,4,6-tri-O-methyl-2-O-(2,3,4,6-tetra-O-methyl-.beta.-D-glucopyranos yl)-
Alternate Name(s) .beta.-D-glucopyranosyl-(1 to 2)-D-glucopyranose Methyl 3,4,6-tri-O-methyl-2-O-(2,3,4,6-tetra-O-methyl-.beta.-D-glucopyranosyl)-D-glucopyranoside Sophorose (permethylated)
CAS Registry Number 60660-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H38O11
InChI InChI=1S/C20H38O11/c1-21-9-11-14(24-4)16(26-6)18(19(28-8)29-11)31-20-17(27-7)15(25-5)13(23-3)12(30-20)10-22-2/h11-20H,9-10H2,1-8H3/t11-,12-,13-,14-,15+,16+,17-,18-,19?,20+/m1/s1
InChIKey JIBCAZMNXQQBIE-AOBLTQEASA-N
Molecular Weight 454.513 g/mol
SMILES [C@@]1([C@]([C@](OC)([C@](OC1OC)(COC)[H])[H])(OC)[H])(O[C@]1([C@@]([C@@](OC)([C@@]([C@](O1)(COC)[H])(OC)[H])[H])(OC)[H])[H])[H]
SPLASH splash10-002r-9520000000-e4ffd7a18bbad6ae41bb
Source of Spectrum KO-2-37-2
Wiley ID 1388654