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fingolimod(1+)

CHEBI:CHEBI_63113

Definition

An organic cation that is the conjugate acid of fingolimod.

Chemical Information

Molecular Formula
C19H34NO2
Molecular Mass
308.47880
Charge
+1
SMILES
CCCCCCCCc1ccc(CCC([NH3+])(CO)CO)cc1
InChI
InChI=1S/C19H33NO2/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-22/h9-12,21-22H,2-8,13-16,20H2,1H3/p+1
InChIKey
KKGQTZUTZRNORY-UHFFFAOYSA-O

Alternative Names

  • 1-hydroxy-2-(hydroxymethyl)-4-(4-octylphenyl)butan-2-aminium
  • fingolimod cation

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

core#notation
CHEBI:63113

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Additional Attributes

chebi#is_conjugate_base_of
http://purl.obolibrary.org/obo/CHEBI_63115
owl#someValuesFrom
t262070
owl#annotatedSource
t262457
oboInOwl#hasOBONamespace
chebi_ontology
oboInOwl#id
CHEBI:63113
core#notation
CHEBI:63113
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
chebi#is_conjugate_acid_of
http://purl.obolibrary.org/obo/CHEBI_63115
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class