Preferred Name |
Fexofenadine hydrochloride |
|
Synonyms |
Allegra (TN) Fexofenadine hydrochloride |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_5051 |
|
alternative term |
Allegra (TN) Fexofenadine hydrochloride |
|
charge |
0 |
|
database_cross_reference |
KEGG:D00671 CAS:153439-40-8 CAS:138452-21-8 |
|
formula |
C32H39NO4.HCl C32H40ClNO4 |
|
has_exact_synonym |
Fexofenadine hydrochloride |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
Allegra (TN) |
|
id |
CHEBI:5051 |
|
in_subset | ||
inchi |
InChI=1S/C32H39NO4.ClH/c1-31(2,30(35)36)25-17-15-24(16-18-25)29(34)14-9-21-33-22-19-28(20-23-33)32(37,26-10-5-3-6-11-26)27-12-7-4-8-13-27;/h3-8,10-13,15-18,28-29,34,37H,9,14,19-23H2,1-2H3,(H,35,36);1H |
|
inchikey |
RRJFVPUCXDGFJB-UHFFFAOYSA-N |
|
label |
Fexofenadine hydrochloride |
|
mass |
538.118 |
|
monoisotopicmass |
537.26459 |
|
notation |
CHEBI:5051 |
|
prefLabel |
Fexofenadine hydrochloride |
|
smiles |
C1=CC=CC(=C1)C(C=2C=CC=CC2)(C3CCN(CC3)CCCC(C4=CC=C(C=C4)C(C(O)=O)(C)C)O)O.Cl |
|
subClassOf |
Create mapping