S5V

2-methyl-5-propan-2-yl-phenol

Created:2022-12-13
Last modified:  2023-03-22

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Chemical Details

Formal Charge0
Atom Count25
Chiral Atom Count0
Bond Count25
Aromatic Bond Count6
2D diagram of S5V

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Chemical Component Summary

Name2-methyl-5-propan-2-yl-phenol
Systematic Name (OpenEye OEToolkits)2-methyl-5-propan-2-yl-phenol
FormulaC10 H14 O
Molecular Weight150.218
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385CC(C)c1ccc(C)c(O)c1
SMILESOpenEye OEToolkits3.1.0.0Cc1ccc(cc1O)C(C)C
Canonical SMILESCACTVS3.385 CC(C)c1ccc(C)c(O)c1
Canonical SMILESOpenEye OEToolkits3.1.0.0 Cc1ccc(cc1O)C(C)C
InChIInChI1.06 InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3
InChIKeyInChI1.06 RECUKUPTGUEGMW-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB16404 
NameCarvacrol
Groups experimental
Synonyms
  • p-Cymen-2-ol
  • Carvacrol
  • 5-Isopropyl-o-cresol
Categories
  • Benzene Derivatives
  • Monoterpenes
  • Terpenes
CAS number499-75-2

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Transient receptor potential cation channel subfamily V member 3MKAHPKEMVPLMGKRVAAPSGNPAILPEKRPAEITPTKKSAHFFLEIEGF...unknownactivator
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
Pharos CHEMBL281202
PubChem 10364
ChEMBL CHEMBL281202
ChEBI CHEBI:3440
CCDC/CSD HUJQEL, OKUROE, WUTFID, HUSVEZ, WUTFAV