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CHEBI:52686 - (S)-butane-1,2-diol

ChEBI IDCHEBI:52686
ChEBI Name(S)-butane-1,2-diol
Stars
ASCII Name(S)-butane-1,2-diol
DefinitionA butane-1,2-diol of S-configuration.
Last Modified5 March 2021
SubmitterSteve
DownloadsMolfile
FormulaC4H10O2
Net Charge0
Average Mass90.122
Monoisotopic Mass90.06808
SMILESCC[C@H](O)CO
InChIInChI=1S/C4H10O2/c1-2-4(6)3-5/h4-6H,2-3H2,1H3/t4-/m0/s1
InChIKeyBMRWNKZVCUKKSR-BYPYZUCNSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
(S)-butane-1,2-diol (CHEBI:52686) is a butane-1,2-diol (CHEBI:52682)
(S)-butane-1,2-diol (CHEBI:52686) is enantiomer of (R)-butane-1,2-diol (CHEBI:52685)
Incoming Relation(s)
(R)-butane-1,2-diol (CHEBI:52685) is enantiomer of (S)-butane-1,2-diol (CHEBI:52686)
IUPAC Name 
(2S)-butane-1,2-diol
Registry NumbersSources
Beilstein:4290600Beilstein