C1R

4-PIPERIDINEBUTYRATE

Created:2006-02-06
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count28
Chiral Atom Count0
Bond Count28
Aromatic Bond Count0
2D diagram of C1R
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Chemical Component Summary

Name4-PIPERIDINEBUTYRATE
Synonyms4-PIPERIDIN-4-YLBUTANAL
Systematic Name (OpenEye OEToolkits)4-piperidin-4-ylbutanal
FormulaC9 H17 N O
Molecular Weight155.237
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=CCCCC1CCNCC1
SMILESCACTVS3.341O=CCCCC1CCNCC1
SMILESOpenEye OEToolkits1.5.0C1CNCCC1CCCC=O
Canonical SMILESCACTVS3.341 O=CCCCC1CCNCC1
Canonical SMILESOpenEye OEToolkits1.5.0 C1CNCCC1CCCC=O
InChIInChI1.03 InChI=1S/C9H17NO/c11-8-2-1-3-9-4-6-10-7-5-9/h8-10H,1-7H2
InChIKeyInChI1.03 HADYAKDSDIXWOF-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB04654 
Name4-PIPERIDIN-4-YLBUTANAL
Groups experimental
Synonyms4-PIPERIDIN-4-YLBUTANAL

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Serine protease 1MNPLLILTFVAAALAAPFDDDDKIVGGYNCEENSVPYQVSLNSGYHFCGG...unknown
Tryptase beta-2MLNLLLLALPVLASRAYAAPAPGQALQRVGIVGGQEAPRSKWPWQVSLRV...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 11840929