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
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
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.
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.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
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)-Propane-1,2-diolKEGG COMPOUND
(R)-1,2-PropanediolKEGG COMPOUND
(R)-Propylene glycolKEGG COMPOUND
(R)-propane-1,2-diolChEBI
R-1,2-PROPANEDIOLPDBeChem
UniProt Name  Source
(R)-propane-1,2-diolUniProt
Manual XrefsDatabases
C02912KEGG COMPOUND
PGRPDBeChem
DB02159DrugBank
Registry NumbersSources
CAS:4254-14-2KEGG COMPOUND