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> Main
CHEBI:55326 - pentolinium tartrate
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ChEBI Name
pentolinium tartrate
ChEBI ID
CHEBI:55326
Definition
The bitartrate salt of pentolinium.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C23H42N2O12
Net Charge
0
Average Mass
538.58580
Monoisotopic Mass
538.27377
InChI
InChI=1S/C15H32N2.2C4H6O6/c1-
16(12-
6-
7-
13-
16)
10-
4-
3-
5-
11-
17(2)
14-
8-
9-
15-
17;2*5-
1(3(7)
8)
2(6)
4(9)
10/h3-
15H2,1-
2H3;2*1-
2,5-
6H,(H,7,8)
(H,9,10)
/q+2;;/p-
2/t;2*1-
,2-
/m.11/s1
InChIKey
HSMKTIKKPMTUQH-WBPXWQEISA-L
SMILES
O[C@H]([C@@H](O)C([O-])=O)C(O)=O.O[C@H]([C@@H](O)C([O-])=O)C(O)=O.C[N+]1(CCCCC[N+]2(C)CCCC2)CCCC1
Roles Classification
Application
(s):
antihypertensive agent
Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
pentolinium tartrate (
CHEBI:55326
)
has part
pentolinium ion (
CHEBI:347401
)
pentolinium tartrate (
CHEBI:55326
)
has role
antihypertensive agent (
CHEBI:35674
)
pentolinium tartrate (
CHEBI:55326
)
is a
tartrate salt (
CHEBI:50562
)
IUPAC Name
1,1'-
pentane-
1,5-
diylbis(1-
methylpyrrolidinium) bis[(2
R
,3
R
)-
3-
carboxy-
2,3-
dihydroxypropanoate]
Synonyms
Sources
Pendine
ChemIDplus
Pentalinium tartrate
ChemIDplus
Pentamethylene-1,5-bis(1'-methylpyrrolidinium tartrate)
ChemIDplus
Pentapyrrolidium bitartrate
ChemIDplus
pentolineum tartrate
ChEBI
Pentolinium bitartrate
ChemIDplus
Pentolinium ditartrate
ChemIDplus
Pentolonii tartras
ChemIDplus
Pentolonium tartrate
ChemIDplus
Recuryl
ChemIDplus
Tartrate de pentolonium
ChemIDplus
Tartrato de pentolonio
ChemIDplus
Tensilest
ChemIDplus
Manual Xref
Database
DB01090
DrugBank
View more database links
Registry Numbers
Types
Sources
52-62-0
CAS Registry Number
ChemIDplus
5216205
Beilstein Registry Number
Beilstein
5216205
Reaxys Registry Number
Reaxys
Citations
Types
Sources
13234334
PubMed citation
Europe PMC
13365064
PubMed citation
Europe PMC
13649541
PubMed citation
Europe PMC
14351794
PubMed citation
Europe PMC
14353636
PubMed citation
Europe PMC
588388
PubMed citation
Europe PMC
6196640
PubMed citation
Europe PMC
Last Modified
24 September 2014