CHEBI:28972 - (R)-propane-1,2-diol

ChEBI IDCHEBI:28972
ChEBI Name(R)-propane-1,2-diol
Stars
ASCII Name(R)-propane-1,2-diol
Secondary ChEBI IDsCHEBI:352, CHEBI:18705, CHEBI:44863
Last Modified13 November 2017
DownloadsMolfile
FormulaC3H8O2
Net Charge0
Average Mass76.095
Monoisotopic Mass76.05243
SMILESC[C@@H](O)CO
InChIInChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3/t3-/m1/s1
InChIKeyDNIAPMSPPWPWGF-GSVOUGTGSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Chemical Role:
protic solvent  A polar solvent that is capable of acting as a hydron (proton) donor.
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
allergen  A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
Application:
protic solvent  A polar solvent that is capable of acting as a hydron (proton) donor.
ChEBI Ontology
Outgoing Relation(s)
(R)-propane-1,2-diol (CHEBI:28972) has role Escherichia coli metabolite (CHEBI:76971)
(R)-propane-1,2-diol (CHEBI:28972) has role human metabolite (CHEBI:77746)
(R)-propane-1,2-diol (CHEBI:28972) is a propane-1,2-diol (CHEBI:16997)
(R)-propane-1,2-diol (CHEBI:28972) is enantiomer of (S)-propane-1,2-diol (CHEBI:29002)
Incoming Relation(s)
(S)-propane-1,2-diol (CHEBI:29002) is enantiomer of (R)-propane-1,2-diol (CHEBI:28972)
IUPAC Name 
(2R)-propane-1,2-diol
Synonyms  Source
(R)-1,2-PropanediolKEGG COMPOUND
R-1,2-PROPANEDIOLPDBeChem
(R)-propane-1,2-diolChEBI
(R)-Propane-1,2-diolKEGG COMPOUND
(R)-Propylene glycolKEGG COMPOUND
UniProt Name  Source
(R)-propane-1,2-diolUniProt
Manual XrefsDatabases
C02912KEGG COMPOUND
DB02159DrugBank
PGRPDBeChem
Registry NumbersSources
CAS:4254-14-2KEGG COMPOUND