CHEBI:17177 - cinnamyl alcohol

ChEBI IDCHEBI:17177
ChEBI Namecinnamyl alcohol
Stars
DefinitionA primary alcohol comprising an allyl core with a hydroxy substituent at the 1-position and a phenyl substituent at the 3-position (geometry of the C=C bond unspecified).
Secondary ChEBI IDsCHEBI:3714, CHEBI:13996, CHEBI:23254, CHEBI:23255
Last Modified17 June 2015
DownloadsMolfile
FormulaC9H10O
Net Charge0
Average Mass134.178
Monoisotopic Mass134.07316
SMILESOCC=Cc1ccccc1
InChIInChI=1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-7,10H,8H2
InChIKeyOOCCDEMITAIZTP-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
cinnamyl alcohol (CHEBI:17177) has role plant metabolite (CHEBI:76924)
cinnamyl alcohol (CHEBI:17177) is a primary alcohol (CHEBI:15734)
Incoming Relation(s)
4-hydroxycinnamyl alcohol (CHEBI:28386) has functional parent cinnamyl alcohol (CHEBI:17177)
5-hydroxyconiferyl alcohol (CHEBI:86068) has functional parent cinnamyl alcohol (CHEBI:17177)
caffeyl alcohol (CHEBI:86071) has functional parent cinnamyl alcohol (CHEBI:17177)
cinnamyl acetate (CHEBI:31402) has functional parent cinnamyl alcohol (CHEBI:17177)
sinapyl alcohol (CHEBI:28813) has functional parent cinnamyl alcohol (CHEBI:17177)
(E)-cinnamyl alcohol (CHEBI:33227) is a cinnamyl alcohol (CHEBI:17177)
(Z)-cinnamyl alcohol (CHEBI:33226) is a cinnamyl alcohol (CHEBI:17177)
IUPAC Name 
3-phenylprop-2-en-1-ol
Synonyms  Source
Cinnamyl alcoholKEGG COMPOUND
3-Phenyl-2-propen-1-olKEGG COMPOUND
StyrylcarbinolKEGG COMPOUND
3-phenyl-2-propen-1-olChEBI
ZimtalcoholChemIDplus
UniProt Name  Source
cinnamyl alcoholUniProt
Manual XrefsDatabases
C02394KEGG COMPOUND
CINNAMYL-ALCMetaCyc
HMDB0029697HMDB
Cinnamyl_alcoholWikipedia
C00042390KNApSAcK
Registry NumbersSources
Gmelin:27238Gmelin
Reaxys:1903999Reaxys
CAS:104-54-1KEGG COMPOUND
CAS:104-54-1ChemIDplus
CAS:104-54-1NIST Chemistry WebBook
Citations