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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H18N2O3
Molecular Weight 226.2722
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOPILOCARPIC ACID

SMILES

CC[C@H]([C@H](CO)CC1=CN=CN1C)C(O)=O

InChI

InChIKey=WJRPDGADPABWOY-WCBMZHEXSA-N
InChI=1S/C11H18N2O3/c1-3-10(11(15)16)8(6-14)4-9-5-12-7-13(9)2/h5,7-8,10,14H,3-4,6H2,1-2H3,(H,15,16)/t8-,10+/m0/s1

HIDE SMILES / InChI

Molecular Formula C11H18N2O3
Molecular Weight 226.2722
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 Sat Dec 16 08:36:54 GMT 2023
Edited
by admin
on Sat Dec 16 08:36:54 GMT 2023
Record UNII
VML9DTP0QW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOPILOCARPIC ACID
Common Name English
1,2-SECO-3-ISOPILOCARPIN-2-OIC ACID
Common Name English
PILOCARPINE HYDROCHLORIDE IMPURITY C [EP IMPURITY]
Common Name English
PILOCARPINE NITRATE IMPURITY C [EP IMPURITY]
Common Name English
ISOPILOCARPINIC ACID
Common Name English
1H-IMIDAZOLE-5-BUTANOIC ACID, .ALPHA.-ETHYL-.BETA.-(HYDROXYMETHYL)-1-METHYL-, (.ALPHA.R,.BETA.R)-
Systematic Name English
(2R,3R)-2-ETHYL-3-(HYDROXYMETHYL)-4-(1-METHYL-1H-IMIDAZOL-5-YL)BUTANOIC ACID
Systematic Name English
ISOPILOCARPINATE
Common Name English
PILOCARPINE HYDROCHLORIDE IMPURITY ISOPILOCARPIC ACID [USP IMPURITY]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00187926
Created by admin on Sat Dec 16 08:36:54 GMT 2023 , Edited by admin on Sat Dec 16 08:36:54 GMT 2023
PRIMARY
CAS
34350-99-7
Created by admin on Sat Dec 16 08:36:54 GMT 2023 , Edited by admin on Sat Dec 16 08:36:54 GMT 2023
PRIMARY
FDA UNII
VML9DTP0QW
Created by admin on Sat Dec 16 08:36:54 GMT 2023 , Edited by admin on Sat Dec 16 08:36:54 GMT 2023
PRIMARY
PUBCHEM
3035051
Created by admin on Sat Dec 16 08:36:54 GMT 2023 , Edited by admin on Sat Dec 16 08:36:54 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
UNSPECIFIED
EP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP