CHEBI:77927 - nonan-2-one

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ChEBI Name nonan-2-one
ChEBI ID CHEBI:77927
Definition A methyl ketone that is nonane in which the methylene hydrogens at position 2 are replaced by an oxo group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Trudy
Supplier Information
Download Molfile XML SDF
Formula C9H18O
Net Charge 0
Average Mass 142.23860
Monoisotopic Mass 142.13577
InChI InChI=1S/C9H18O/c1-3-4-5-6-7-8-9(2)10/h3-8H2,1-2H3
InChIKey VKCYHJWLYTUGCC-UHFFFAOYSA-N
SMILES CCCCCCCC(C)=O
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
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ChEBI Ontology
Outgoing nonan-2-one (CHEBI:77927) has parent hydride nonane (CHEBI:32892)
nonan-2-one (CHEBI:77927) has role plant metabolite (CHEBI:76924)
nonan-2-one (CHEBI:77927) is a methyl ketone (CHEBI:51867)
IUPAC Name
nonan-2-one
Synonyms Sources
2-nonanone SUBMITTER
β-nonanone NIST Chemistry WebBook
beta-Nonanone HMDB
heptyl methyl ketone SUBMITTER
Methyl heptyl ketone ChemIDplus
Methyl n-heptyl ketone NIST Chemistry WebBook
n-C7H15COCH3 NIST Chemistry WebBook
nonan-2-one UniProt
NONANONE-2 NIST Chemistry WebBook
NSC 14760 ChemIDplus
Manual Xref Database
HMDB0031266 HMDB
View more database links
Registry Numbers Types Sources
1743645 Beilstein Registry Number ChemIDplus
1743645 Reaxys Registry Number Reaxys
821-55-6 CAS Registry Number ChemIDplus
821-55-6 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
23580469 PubMed citation Europe PMC
24045155 PubMed citation Europe PMC
24262538 PubMed citation Europe PMC
24441709 PubMed citation Europe PMC
24621664 PubMed citation Europe PMC
IND500714276 Agricola citation Europe PMC
Last Modified
24 November 2016