CHEBI:88370 - Hexan-2-ol - EMBL-EBI

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CHEBI:88370 - hexan-2-ol

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ChEBI Name hexan-2-ol
ChEBI ID CHEBI:88370
Definition A hexanol in which the hydroxy group is at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H14O
Net Charge 0
Average Mass 102.177
Monoisotopic Mass 102.10447
InChI InChI=1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3
InChIKey QNVRIHYSUZMSGM-UHFFFAOYSA-N
SMILES CCCCC(C)O
Metabolite of Species Details
Osyris wightiana (NCBI:txid210363) See: PubMed
Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: PubMed
Roles Classification
Biological Role(s): semiochemical A molecular messenger released by an organism that affects the behaviour within or between species. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing hexan-2-ol (CHEBI:88370) has role human metabolite (CHEBI:77746) hexan-2-ol (CHEBI:88370) has role plant metabolite (CHEBI:76924) hexan-2-ol (CHEBI:88370) has role semiochemical (CHEBI:26645) hexan-2-ol (CHEBI:88370) is a hexanol (CHEBI:143552) hexan-2-ol (CHEBI:88370) is a secondary alcohol (CHEBI:35681)
IUPAC Name
hexan-2-ol
Synonyms Sources
1-methyl-1-pentanol ChEBI
2-hexanol ChemIDplus
2-hexyl alcohol NIST Chemistry WebBook
2-hydroxyhexane ChemIDplus
hexan-2-ol UniProt
n-butylmethylcarbinol NIST Chemistry WebBook
n-C4H9CH(OH)CH3 NIST Chemistry WebBook
n-hexan-2-ol NIST Chemistry WebBook
sec-hexyl alcohol ChemIDplus
Manual Xrefs Databases
11794 ChemSpider
2-Hexanol Wikipedia
CPD-18993 MetaCyc
FDB004514 FooDB
HMDB0061886 HMDB
LMFA05000467 LIPID MAPS
View more database links
Registry Numbers Types Sources
1718996 Reaxys Registry Number Reaxys
626-93-7 CAS Registry Number ChemIDplus
626-93-7 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
10469537 PubMed citation Europe PMC
11446806 PubMed citation Europe PMC
22936621 PubMed citation Europe PMC
24657864 PubMed citation Europe PMC
26369156 PubMed citation Europe PMC
26476310 PubMed citation Europe PMC
30758196 PubMed citation Europe PMC
31461927 PubMed citation Europe PMC
32772709 PubMed citation Europe PMC
33276068 PubMed citation Europe PMC
33671950 PubMed citation Europe PMC
6296504 PubMed citation Europe PMC
734671 PubMed citation Europe PMC
IND601242539 Agricola citation Europe PMC
Last Modified
07 October 2021

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