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(2R,3R,4R)-2-methoxy-3,4-dihydro-2H-pyran-3,4,5-triol

PubChem CID: 44149648

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Compound Synonyms UNII-M7F3LRN53I, M7F3LRN53I, EINECS 215-755-3
Topological Polar Surface Area 79.2
Hydrogen Bond Donor Count 3.0
Heavy Atom Count 11.0
Description Lichenin, also known as lichenan or moss starch, is a complex glucan occurring in certain species of lichens. It can be extracted from Cetraria islandica (Iceland moss). It has been studied since about 1957. Chemically, lichenin consists of repeating glucose units linked by β-1,3 and β-1,4 glycosidic bonds . Lichenin is soluble (in water) and a very weakly acidic compound (based on its pKa). Lichenin can be found in oat, which makes lichenin a potential biomarker for the consumption of this food product.
Isotope Atom Count 0.0
Molecular Complexity 166.0
Database Name fooddb_chem_all;hmdb_chem_all;pubchem
Defined Atom Stereocenter Count 3.0
Iupac Name (2R,3R,4R)-2-methoxy-3,4-dihydro-2H-pyran-3,4,5-triol
Nih Violation False
Class Organooxygen compounds
Xlogp -1.6
Superclass Organic oxygen compounds
Is Pains False
Subclass Alcohols and polyols
Molecular Formula C6H10O5
Inchi Key FSOIXBFBUZWTMV-KVQBGUIXSA-N
Rotatable Bond Count 1.0
Synonyms Lichenan
Compound Name (2R,3R,4R)-2-methoxy-3,4-dihydro-2H-pyran-3,4,5-triol
Kingdom Organic compounds
Exact Mass 162.053
Formal Charge 0.0
Brenk Violation False
Monoisotopic Mass 162.053
Hydrogen Bond Acceptor Count 5.0
Molecular Weight 162.14
Covalent Unit Count 1.0
Total Atom Stereocenter Count 3.0
Total Bond Stereocenter Count 0.0
Molecular Framework Aliphatic heteromonocyclic compounds
Inchi InChI=1S/C6H10O5/c1-10-6-5(9)4(8)3(7)2-11-6/h2,4-9H,1H3/t4-,5+,6+/m0/s1
Smiles CO[C@H]1[C@@H]([C@H](C(=CO1)O)O)O
Defined Bond Stereocenter Count 0.0
Taxonomy Direct Parent 1,2-diols

  • 1. Outgoing r'ship FOUND_IN to/from Avena Sativa (Plant) Rel Props:Source_db:fooddb_chem_all