CHEBI:9453 - Terfenadine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Terfenadine
ChEBI ID CHEBI:9453
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C32H41NO2
C32H41NO2
Net Charge 0
Average Mass 471.675
Monoisotopic Mass 471.314
InChI InChI=1S/C32H41NO2/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29-30,34-35H,10,15,20-24H2,1-3H3
InChIKey GUGOEEXESWIERI-UHFFFAOYSA-N
SMILES CC(C)(C)c1ccc(cc1)C(O)CCCN1CCC(CC1)C(O)(c1ccccc1)c1ccccc1
ChEBI Ontology
Outgoing Terfenadine (CHEBI:9453) is a diarylmethane (CHEBI:51614)
Synonyms Sources
racemic terfenadine DrugCentral
seldane DrugCentral
Terfenadine KEGG COMPOUND
ternadin DrugCentral
Manual Xrefs Databases
2600 DrugCentral
C07463 KEGG COMPOUND
D00521 KEGG DRUG
LSM-1273 LINCS
View more database links
Registry Number Type Source
50679-08-8 CAS Registry Number KEGG COMPOUND
Last Modified
22 February 2017