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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:50270 - pantoprazole sodium
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ChEBI Ontology
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ChEBI Name
pantoprazole sodium
ChEBI ID
CHEBI:50270
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C16H14F2N3NaO4S
Net Charge
0
Average Mass
405.35276
Monoisotopic Mass
405.05708
InChI
InChI=1S/C16H14F2N3O4S.Na/c1-
23-
13-
5-
6-
19-
12(14(13)
24-
2)
8-
26(22)
16-
20-
10-
4-
3-
9(25-
15(17)
18)
7-
11(10)
21-
16;/h3-
7,15H,8H2,1-
2H3;/q-
1;+1
InChIKey
YNWDKZIIWCEDEE-UHFFFAOYSA-N
SMILES
[Na+].COc1ccnc(CS(=O)c2nc3cc(OC(F)F)ccc3[n-]2)c1OC
Roles Classification
Biological Role
(s):
EC 3.6.3.10 (H(+)/K(+)-exchanging ATPase) inhibitor
An EC 3.6.3.* (acid anhydride hydrolase catalysing transmembrane movement of substances) inhibitor that inhibits H
+
/K
+
-exchanging ATPase, EC 3.6.3.10. Such compounds are also known as proton pump inhibitors.
Application
(s):
anti-ulcer drug
One of various classes of drugs with different action mechanisms used to treat or ameliorate peptic ulcer or irritation of the gastrointestinal tract.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
pantoprazole sodium (
CHEBI:50270
)
has part
pantoprazole(1−) (
CHEBI:50358
)
pantoprazole sodium (
CHEBI:50270
)
has role
anti-ulcer drug (
CHEBI:49201
)
pantoprazole sodium (
CHEBI:50270
)
has role
EC 3.6.3.10 (
H
+
/
K
+
-exchanging ATPase) inhibitor (
CHEBI:49200
)
pantoprazole sodium (
CHEBI:50270
)
is a
organic sodium salt (
CHEBI:38700
)
IUPAC Name
sodium 5-(difluoromethoxy)-2-{[(3,4-dimethoxypyridin-2-yl)methyl]sulfinyl}benzimidazol-1-ide
Brand Names
Sources
Citrel
ChEBI
Protium
DrugBank
Protonix
DrugBank
Manual Xref
Database
DB00213
DrugBank
View more database links
Registry Numbers
Types
Sources
138786-67-1
CAS Registry Number
ChemIDplus
5372611
Beilstein Registry Number
Beilstein
Last Modified
24 November 2008