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CHEBI:44884 - pentan-1-ol

ChEBI IDCHEBI:44884
ChEBI Namepentan-1-ol
Stars
DefinitionA short-chain primary fatty alcohol that is pentane in which a hydrogen of one of the methyl groups is substituted by a hydroxy group. It has been isolated from Melicope ptelefolia.
Last Modified25 October 2023
DownloadsMolfile

FormulaC5H12O
Net Charge0
Average Mass88.150
Monoisotopic Mass88.08882
SMILESCCCCCO
InChIInChI=1S/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3
InChIKeyAMQJEAYHLZJPGS-UHFFFAOYSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
saliva (UBERON:0001836) PubMed (24421258)
faeces (UBERON:0001988) PubMed (17314143)
blood serum (BTO:0000133) MetaboLights (MTBLS298)
Roles Classification

ChEBI Ontology
IUPAC Name 
pentan-1-ol
Synonyms  Source
1-pentanolNIST Chemistry WebBook
n-pentyl alcoholChemIDplus
1-pentyl alcoholChemIDplus
n-amyl alcoholChemIDplus
n-Amylalkohol  deChemIDplus
Amylalkohol  deChEBI
Manual XrefsDatabases
PE9PDBeChem
PENTANOLMetaCyc
HMDB0013036HMDB
1-PentanolWikipedia
C16834KEGG COMPOUND
C00035784KNApSAcK
Registry NumbersSources
Gmelin:25922Gmelin
Reaxys:1730975Reaxys
CAS:71-41-0NIST Chemistry WebBook
CAS:71-41-0ChemIDplus
Citations