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CHEBI:87679 - 3-[(2-hydroxyethyl)thio]-1-propanol

ChEBI IDCHEBI:87679
ChEBI Name3-[(2-hydroxyethyl)thio]-1-propanol
Stars
DefinitionAn aliphatic sulfide that is propan-1-ol substituted by a (2-hydroxyethyl)thio group at position 3.
Last Modified27 August 2015
Submitternamrata
DownloadsMolfile
FormulaC5H12O2S
Net Charge0
Average Mass136.216
Monoisotopic Mass136.05580
SMILESOCCCSCCO
InChIInChI=1S/C5H12O2S/c6-2-1-4-8-5-3-7/h6-7H,1-5H2
InChIKeyYJGRQEWXDDCCCV-UHFFFAOYSA-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)
3-[(2-hydroxyethyl)thio]-1-propanol (CHEBI:87679) has role metabolite (CHEBI:25212)
3-[(2-hydroxyethyl)thio]-1-propanol (CHEBI:87679) is a aliphatic sulfide (CHEBI:22327)
3-[(2-hydroxyethyl)thio]-1-propanol (CHEBI:87679) is a diol (CHEBI:23824)
IUPAC Name 
3-[(2-hydroxyethyl)sulfanyl]propan-1-ol
Registry NumbersSources
Reaxys:1734411Reaxys