Secondary metabolite:4-Allylphenol



EOCID000816
Summary

sCentInDB Chemical identifier: EOCID000816

Chemical name: 4-Allylphenol

Molecular formula: C9H10O

SMILES: C=CCc1ccc(cc1)O

InChI: InChI=1S/C9H10O/c1-2-3-8-4-6-9(10)7-5-8/h2,4-7,10H,1,3H2

InChIKey: RGIBXDHONMXTLI-UHFFFAOYSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Benzenoids

Class: Phenols

Subclass: 1-hydroxy-2-unsubstituted benzenoids


Synonymous chemical name(s):
chavicol, 4-allylphenol


External chemical identifier(s):
CID:68148, CHEMBL108862, CHEBI:50158, CHEMSPIDER:21105856, ZINC000001565456, FDASRS:Q5ER4K6969, MOLPORT:006-111-494, SURECHEMBL:SCHEMBL30870


Spectrabase ID:
7VFscsAf039


Chemical structure download

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