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Details

Stereochemistry ACHIRAL
Molecular Formula C11H14N2S.C6H8O7
Molecular Weight 398.431
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of PYRANTEL CITRATE

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.CN1CCCN=C1\C=C\C2=CC=CS2

InChI

InChIKey=YJGGCARNRYGSPA-IPZCTEOASA-N
InChI=1S/C11H14N2S.C6H8O7/c1-13-8-3-7-12-11(13)6-5-10-4-2-9-14-10;7-3(8)1-6(13,5(11)12)2-4(9)10/h2,4-6,9H,3,7-8H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b6-5+;

HIDE SMILES / InChI

Molecular Formula C11H14N2S
Molecular Weight 206.307
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula C6H8O7
Molecular Weight 192.1235
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:45:22 UTC 2023
Edited
by admin
on Fri Dec 15 19:45:22 UTC 2023
Record UNII
1YXE665Z2S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PYRANTEL CITRATE
Common Name English
PYRIMIDINE, 1,4,5,6-TETRAHYDRO-1-METHYL-2-(2-(2-THIENYL)VINYL)-, CITRATE (1:1)
Systematic Name English
1-METHYL-2-(2-(2-THIENYL)VINYL)-.DELTA.2-TETRAHYDROPYRIMIDINE CITRATE
Systematic Name English
PYRIMIDINE, 1,4,5,6-TETRAHYDRO-1-METHYL-2-((1E)-2-(2-THIENYL)ETHENYL)-, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
6436405
Created by admin on Fri Dec 15 19:45:22 UTC 2023 , Edited by admin on Fri Dec 15 19:45:22 UTC 2023
PRIMARY
DRUG BANK
DBSALT002662
Created by admin on Fri Dec 15 19:45:22 UTC 2023 , Edited by admin on Fri Dec 15 19:45:22 UTC 2023
PRIMARY
EPA CompTox
DTXSID401034016
Created by admin on Fri Dec 15 19:45:22 UTC 2023 , Edited by admin on Fri Dec 15 19:45:22 UTC 2023
PRIMARY
FDA UNII
1YXE665Z2S
Created by admin on Fri Dec 15 19:45:22 UTC 2023 , Edited by admin on Fri Dec 15 19:45:22 UTC 2023
PRIMARY
ECHA (EC/EINECS)
227-154-3
Created by admin on Fri Dec 15 19:45:22 UTC 2023 , Edited by admin on Fri Dec 15 19:45:22 UTC 2023
PRIMARY
CAS
5685-86-9
Created by admin on Fri Dec 15 19:45:22 UTC 2023 , Edited by admin on Fri Dec 15 19:45:22 UTC 2023
PRIMARY
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