Phenyl-alpha-2-fucosyl-beta-D-galactoside structure

Phenyl-alpha-2-fucosyl-beta-D-galactoside

(2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-phenoxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol

Also Known As: PAFBG|Phenyl-alpha-2-fucosyl-beta-D-galactoside|Phenyl 2-O-(6-deoxyhexopyranosyl)hexopyranoside|A-d-galactopyranoside, phenyl2-o-(6-deoxy-|A-l-galactopyranosyl)-|beta-D-Galactopyranoside, phenyl 2-O-(6-deoxy-alpha-L-galactopyranosyl)-|phenyl 2-O-(6-deoxy-alpha-L-galactopyranosyl)-beta-D-galactopyranoside|(2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-phenoxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol

CAS: 84746-03-2
Molecular Formula C18H26O10
Molecular Weight 402.1526 g/mol
LogP -2.0
Topological Polar Surface Area 158.0 Ų
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 10
Rotatable Bonds 5
Exact Mass 402.1526
Monoisotopic Mass 402.1526
Heavy Atoms 28
Complexity 487.0

Chemical Identifiers

CAS Number 84746-03-2
SMILES C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H]([C@H]([C@H](O[C@H]2OC3=CC=CC=C3)CO)O)O)O)O)O
InChIKey XUSMCHNFKFZYCZ-KHFTUBCFSA-N

Product Overview

Phenyl-alpha-2-fucosyl-beta-D-galactoside (CAS 84746-03-2), with molecular formula C18H26O10 and molecular weight 402.1526 g/mol. IUPAC: (2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-phenoxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol.

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