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ChEBI
> Main
CHEBI:16959 - albendazole
S
-oxide
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ChEBI Name
albendazole
S
-oxide
ChEBI ID
CHEBI:16959
ChEBI ASCII Name
albendazole S-oxide
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:2546, CHEBI:13752, CHEBI:22287
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Formula
C12H15N3O3S
Net Charge
0
Average Mass
281.33192
Monoisotopic Mass
281.08341
InChI
InChI=1S/C12H15N3O3S/c1-
3-
6-
19(17)
8-
4-
5-
9-
10(7-
8)
14-
11(13-
9)
15-
12(16)
18-
2/h4-
5,7H,3,6H2,1-
2H3,(H2,13,14,15,16)
InChIKey
VXTGHWHFYNYFFV-UHFFFAOYSA-N
SMILES
CCCS(=O)c1ccc2[nH]c(NC(=O)OC)nc2c1
ChEBI Ontology
Outgoing
albendazole
S
-oxide (
CHEBI:16959
)
has functional parent
albendazole (
CHEBI:16664
)
albendazole
S
-oxide (
CHEBI:16959
)
is a
sulfoxide (
CHEBI:22063
)
Incoming
(
R
)-albendazole
S
-oxide (
CHEBI:40763
)
is a
albendazole
S
-oxide (
CHEBI:16959
)
(
S
)-albendazole
S
-oxide (
CHEBI:38950
)
is a
albendazole
S
-oxide (
CHEBI:16959
)
IUPAC Name
methyl [5-(propylsulfinyl)-1
H
-benzimidazol-2-yl]carbamate
Synonyms
Sources
(±)-albendazole sulfoxide
ChemIDplus
albendazole oxide
ChemIDplus
Albendazole S-oxide
KEGG COMPOUND
albendazole
S
-oxide
UniProt
albendazole sulfoxide
ChemIDplus
Ricobendazole
ChemIDplus
Rycobendazole
ChemIDplus
Manual Xrefs
Databases
104
DrugCentral
C02809
KEGG COMPOUND
D07106
KEGG DRUG
View more database links
Registry Numbers
Types
Sources
54029-12-8
CAS Registry Number
ChemIDplus
677664
Beilstein Registry Number
Beilstein
Last Modified
22 February 2017