Secondary metabolite:6-Methyl-5-hepten-2-one



EOCID000144
Summary

sCentInDB Chemical identifier: EOCID000144

Chemical name: 6-Methyl-5-hepten-2-one

Molecular formula: C8H14O

SMILES: CC(=O)CCC=C(C)C

InChI: InChI=1S/C8H14O/c1-7(2)5-4-6-8(3)9/h5H,4,6H2,1-3H3

InChIKey: UHEPJGULSIKKTP-UHFFFAOYSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Organic oxygen compounds

Class: Organooxygen compounds

Subclass: Carbonyl compounds


Synonymous chemical name(s):
6-methyl 5 hepten-2-one, methyl heptenone, 6-methylhept-5-en-2-one, methylheptenone, sulcatone, 6-methyl-5-hepten-2-one, 6-methyl-5-heptene-2-one, 6-methyl-5-heptenone, 6-methyl hept-5-en-2-one, 6-methyl-hept-5-en-2-one, 6-methyl 5-hepten-2-one, 6-methyl hept-5-ene-2-one, 6-methylhept-5-ene-2-one, 6-methyl-5-heptanone


External chemical identifier(s):
CID:9862, CHEMBL46340, CHEBI:16310, CHEMSPIDER:9478, ZINC000000896810, FDASRS:448353S93V, MOLPORT:001-788-424, SURECHEMBL:SCHEMBL157735


Spectrabase ID:
ly0hJBX17N


Chemical structure download

2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT
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