Preferred Name

Ondansetron hydrochloride

Synonyms

Ondansetron hydrochloride

Zofran (TN)

ID

http://purl.obolibrary.org/obo/CHEBI_7774

charge

0

database_cross_reference

KEGG:D00678

CAS:103639-04-9

formula

C18H19N3O.HCl.2H2O

C18H24ClN3O3

has_exact_synonym

Ondansetron hydrochloride

has_obo_namespace

chebi_ontology

has_related_synonym

Zofran (TN)

id

CHEBI:7774

in_subset

http://purl.obolibrary.org/obo/chebi#2_STAR

inchi

InChI=1S/C18H19N3O.ClH.2H2O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2;;;/h3-6,9-10,13H,7-8,11H2,1-2H3;1H;2*1H2

inchikey

VRSLTNZJOUZKLX-UHFFFAOYSA-N

label

Ondansetron hydrochloride

mass

365.855

monoisotopicmass

365.15062

notation

CHEBI:7774

prefLabel

Ondansetron hydrochloride

smiles

C=12C=3C(=CC=CC3)N(C1CCC(C2=O)CN4C(=NC=C4)C)C.Cl.O.O

subClassOf

http://purl.obolibrary.org/obo/CHEBI_48513

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