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Benzyl (Benzyl 3,4-O-Isopropylidene-D-galactopyranosid)uronate
SpectraBase Compound ID AEcZfbxc7Us
InChI InChI=1S/C23H26O7/c1-23(2)29-18-17(24)22(27-14-16-11-7-4-8-12-16)28-20(19(18)30-23)21(25)26-13-15-9-5-3-6-10-15/h3-12,17-20,22,24H,13-14H2,1-2H3/t17-,18-,19-,20+,22+/m1/s1
InChIKey YLRKTHOSHNJUEP-YHZBMZHBSA-N
Mol Weight 414.45 g/mol
Molecular Formula C23H26O7
Exact Mass 414.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPNkcQoaJBA
Name Benzyl (Benzyl 3,4-O-Isopropylidene-D-galactopyranosid)uronate
Alternate Name(s) (3aR,4S,6S,7R,7aR)-6-Benzyloxy-7-hydroxy-2,2-dimethyl-tetrahydro-[1,3]dioxolo[4,5-c]pyran-4-carboxylic acid benzyl ester dibenzyl 3,4-O-(1-methylethylidene)-.alpha.-D-galactopyranosiduronate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26O7
InChI InChI=1S/C23H26O7/c1-23(2)29-18-17(24)22(27-14-16-11-7-4-8-12-16)28-20(19(18)30-23)21(25)26-13-15-9-5-3-6-10-15/h3-12,17-20,22,24H,13-14H2,1-2H3/t17-,18-,19-,20+,22+/m1/s1
InChIKey YLRKTHOSHNJUEP-YHZBMZHBSA-N
Molecular Weight 414.454 g/mol
SMILES O[C@@]1([C@@]2([C@]([C@](O[C@@]1(OCc1ccccc1)[H])(C(OCc1ccccc1)=O)[H])(OC(C)(C)O2)[H])[H])[H]
SPLASH splash10-0005-0089000000-f98f97f4ee72d2e7480d
Source of Spectrum J-63-2104-11
Wiley ID 1375408