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CHEBI:27444 - but-3-yn-1-ol

ChEBI IDCHEBI:27444
ChEBI Namebut-3-yn-1-ol
Stars
DefinitionA terminal acetylenic compound that is but-1-yne with one of the methyl hydrogens substituted by a hydroxy group.
Secondary ChEBI IDsCHEBI:1460, CHEBI:19969
Last Modified7 March 2016
DownloadsMolfile
FormulaC4H6O
Net Charge0
Average Mass70.091
Monoisotopic Mass70.04186
SMILESC#CCCO
InChIInChI=1S/C4H6O/c1-2-3-4-5/h1,5H,3-4H2
InChIKeyOTJZCIYGRUNXTP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
but-3-yn-1-ol (CHEBI:27444) is a butyn-1-ols (CHEBI:22967)
but-3-yn-1-ol (CHEBI:27444) is a terminal acetylenic compound (CHEBI:73477)
Incoming Relation(s)
but-3-yn-1-yl β-D-glucoside (CHEBI:131455) has functional parent but-3-yn-1-ol (CHEBI:27444)
α-D-Galp-(1→3)-β-D-Galp-(1→4)-β-D-GlcpNAcO[CH2]2C≡CH (CHEBI:131457) has functional parent but-3-yn-1-ol (CHEBI:27444)
IUPAC Name 
but-3-yn-1-ol
Synonyms  Source
3-Butyn-1-olKEGG COMPOUND
1-butyn-4-olNIST Chemistry WebBook
3-butynyl alcoholNIST Chemistry WebBook
4-hydroxy-1-butyneNIST Chemistry WebBook
3-butynolNIST Chemistry WebBook
homopropargyl alcoholChEBI
UniProt Name  Source
but-3-yn-1-olUniProt
Manual XrefsDatabases
C06146KEGG COMPOUND
CH680439Patent
Registry NumbersSources
Reaxys:773710Reaxys
CAS:927-74-2ChemIDplus
CAS:927-74-2KEGG COMPOUND
CAS:927-74-2NIST Chemistry WebBook
Citations