LYL

2-ALLYL-6-METHYL-PHENOL

Created: 2003-03-28
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count23
Chiral Atom Count0
Bond Count23
Aromatic Bond Count6
2D diagram of LYL

Chemical Component Summary

Name2-ALLYL-6-METHYL-PHENOL
Systematic Name (OpenEye OEToolkits)2-methyl-6-prop-2-enyl-phenol
FormulaC10 H12 O
Molecular Weight148.202
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04Oc1c(cccc1C/C=C)C
SMILESCACTVS3.341Cc1cccc(CC=C)c1O
SMILESOpenEye OEToolkits1.5.0Cc1cccc(c1O)CC=C
Canonical SMILESCACTVS3.341 Cc1cccc(CC=C)c1O
Canonical SMILESOpenEye OEToolkits1.5.0 Cc1cccc(c1O)CC=C
InChIInChI1.03 InChI=1S/C10H12O/c1-3-5-9-7-4-6-8(2)10(9)11/h3-4,6-7,11H,1,5H2,2H3
InChIKeyInChI1.03 WREVCRYZAWNLRZ-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB03301 
Name2-Allyl-6-Methyl-Phenol
Groups experimental
Synonyms2-Allyl-6-Methyl-Phenol

Drug Targets

NameTarget SequencePharmacological ActionActions
EndolysinMNIFEMLRIDERLRLKIYKDTEGYYTIGIGHLLTKSPSLNAAKSELDKAI...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 76883