ethyl 4-O-alpha-D-galactopyranosyl-beta-D-galactopyranoside
Basic information
- CAS
87019-36-1- Standard SMILES
CCO[C@@H]1O[C@H](CO)[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O- InChIKey
KTBPXDPDLAKMMM-AGMWUUFMSA-N- Molecular formula
- C14H26O11
- Average molar mass
- 370.35 g/mol
- Monoisotopic mass
- 370.14751164
Overview
Alpha-D-Gal-(1->4)-beta-D-Gal-OEt is a glycoside that consists of ethyl beta-D-galactoside having an alpha-D-galactosyl residue at the 4-position. It is a glycoside and a disaccharide derivative.
Names & identifiers
- Preferred name
- ethyl 4-O-alpha-D-galactopyranosyl-beta-D-galactopyranoside
- IUPAC
- (2R,3R,4S,5R,6R)-2-[(2R,3R,4R,5R,6R)-6-ethoxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Names & synonyms
Galalpha1-4Galbeta-OEtalpha-D-Gal-(1->4)-beta-D-Gal-OEtethyl 4-O-alpha-D-galactopyranosyl-beta-D-galactopyranosidealpha-D-Galp-(1->4)-beta-D-Galp-OEtalpha-D-galactosyl-(1->4)-beta-D-galactosyl-OEtethyl alpha-D-galactosyl-(1->4)-beta-D-galactosideethyl alpha-D-galactopyranosyl-(1->3)-alpha-D-galactopyranosideCHEBI:63025DTXSID40122038087019-36-1Q27132342Ethyl 4-O-I+/--D-galactopyranosyl-I(2)-D-galactopyranoside
Database identifiers
- CAS
87019-36-1- PubChem CID
- 53477593
- DTXSID
DTXSID401220380- ChEBI
CHEBI:63025
Properties
Computed structural properties
- XLogP
- -3.8
- Topological polar surface area
- 179 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 410
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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