erlotinib

CHEBI:CHEBI_114785

Definition

A quinazoline compound having a (3-ethynylphenyl)amino group at the 4-position and two 2-methoxyethoxy groups at the 6- and 7-positions.

Chemical Information

Molecular Formula
C22H23N3O4
Molecular Mass
393.43570
Charge
0
SMILES
COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC
InChI
InChI=1S/C22H23N3O4/c1-4-16-6-5-7-17(12-16)25-22-18-13-20(28-10-8-26-2)21(29-11-9-27-3)14-19(18)23-15-24-22/h1,5-7,12-15H,8-11H2,2-3H3,(H,23,24,25)
InChIKey
AAKJLRGGTJKAMG-UHFFFAOYSA-N

Alternative Names

  • [6,7-bis-(2-methoxy-ethoxy)-quinazolin-4-yl]-(3-ethynyl-phenyl)-amine
  • [6,7-bis(2-methoxy-ethoxy)quinazoline-4-yl]-(3-ethynylphenyl)amine
  • erlotinib
  • erlotinibum
  • N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine

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

DRON_00010000
337525
oboInOwl#hasDbXref
Wikipedia:Erlotinib
core#notation
CHEBI:114785

Additional References

Wikipedia:Erlotinib

🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.

Additional Attributes

oboInOwl#hasOBONamespace
chebi_ontology
DRON_00010000
337525
oboInOwl#hasDbXref
Wikipedia:Erlotinib
oboInOwl#id
CHEBI:114785
core#notation
CHEBI:114785
oboInOwl#hasAlternativeId
CHEBI:40877
RO_0000087
http://purl.obolibrary.org/obo/CHEBI_74440
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
has_treatment
http://purl.obolibrary.org/obo/DOID_0070552
rdf-schema#domain
https://w3id.org/def/predibionto#has_side_effect1595
owl#annotatedSource
t96765
owl#someValuesFrom
t965582