Secondary metabolite:beta-Cyclocitral



EOCID002999
Summary

sCentInDB Chemical identifier: EOCID002999

Chemical name: beta-Cyclocitral

Molecular formula: C10H16O

SMILES: O=CC1=C(C)CCCC1(C)C

InChI: InChI=1S/C10H16O/c1-8-5-4-6-10(2,3)9(8)7-11/h7H,4-6H2,1-3H3

InChIKey: MOQGCGNUWBPGTQ-UHFFFAOYSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Organic oxygen compounds

Class: Organic oxides

Subclass:


Synonymous chemical name(s):
1-cyclohexene-1-carboxaldehyde,2,6,6-trimethyl, β-cyclocitral


External chemical identifier(s):
CID:9895, CHEMBL1952257, CHEBI:53177, CHEMSPIDER:9511, ZINC000005766948, FDASRS:77Y0U2X29G, MOLPORT:001-794-308, SURECHEMBL:SCHEMBL309759


Spectrabase ID:
BKNrLvMicry


Chemical structure download

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