Chemical Component Summary

NamePROPYL ACETATE
Identifierspropyl ethanoate
FormulaC5 H10 O2
Molecular Weight102.132
TypeNON-POLYMER
Isomeric SMILESCCCOC(=O)C
InChIInChI=1S/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3
InChIKeyYKYONYBAUNKHLG-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count17
Chiral Atom Count0
Bond Count16
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB01670 
NamePropyl acetate
Groups experimental
SynonymsPropyl acetate
Categories
  • Acids, Acyclic
  • Fatty Acids
  • Fatty Acids, Volatile
  • Lipids
CAS number109-60-4

Drug Targets

NameTarget SequencePharmacological ActionActions
CarboxylesteraseMKIVPPKPFFFEAGERAVLLLHGFTGNSADVRMLGRFLESKGYTCHAPIY...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 7997
ChEMBL CHEMBL44857
ChEBI CHEBI:40116