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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H32N2.2C4H5O6
Molecular Weight 538.5858
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENTOLINIUM TARTRATE

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+]2(CCCCC[N+]1(C)CCCC1)CCCC2

InChI

InChIKey=HSMKTIKKPMTUQH-WBPXWQEISA-L
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

HIDE SMILES / InChI

Molecular Formula C15H32N2
Molecular Weight 240.428
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C4H6O6
Molecular Weight 150.0868
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:09:32 UTC 2023
Edited
by admin
on Fri Dec 15 15:09:32 UTC 2023
Record UNII
953357GACY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PENTOLINIUM TARTRATE
MI   ORANGE BOOK  
Common Name English
ANSOLYSEN
Brand Name English
PENTOLINIUM TARTRATE [MI]
Common Name English
PENTOLONIUM TARTRATE [MART.]
Common Name English
Pentolonium tartrate [WHO-DD]
Common Name English
pentolonium tartrate [INN]
Common Name English
NSC-759890
Code English
PENTOLONIUM TARTRATE
INN   MART.   WHO-DD  
INN  
Official Name English
PYRROLIDINIUM 1,1'-(1,5-PENTANEDIYL)BIS-(1-METHYL-, (R-(R*,R*))-2,3-DIHYDROXYBUTANEDIOATE
Common Name English
PENTOLINIUM TARTRATE [ORANGE BOOK]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C270
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
NCI_THESAURUS C66886
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
Code System Code Type Description
NSC
759890
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
FDA UNII
953357GACY
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
PUBCHEM
5849
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
EVMPD
SUB09700MIG
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
MERCK INDEX
m8515
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY Merck Index
EPA CompTox
DTXSID5045542
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
NCI_THESAURUS
C66345
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
DRUG BANK
DBSALT000236
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
MESH
D010425
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
CHEBI
55326
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
CAS
52-62-0
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
SMS_ID
100000082536
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
ECHA (EC/EINECS)
200-146-7
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
ChEMBL
CHEMBL1271
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
INN
330
Created by admin on Fri Dec 15 15:09:32 UTC 2023 , Edited by admin on Fri Dec 15 15:09:32 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY