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Details

Stereochemistry ACHIRAL
Molecular Formula 2C9H8N3O3.Ca
Molecular Weight 452.434
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of PYRUVIC ACID CALCIUM ISONIAZID

SMILES

[Ca++].CC(=NNC(=O)C1=CC=NC=C1)C([O-])=O.CC(=NNC(=O)C2=CC=NC=C2)C([O-])=O

InChI

InChIKey=MNXSNBWJLVPGGM-HHWAHKQESA-L
InChI=1S/2C9H9N3O3.Ca/c2*1-6(9(14)15)11-12-8(13)7-2-4-10-5-3-7;/h2*2-5H,1H3,(H,12,13)(H,14,15);/q;;+2/p-2/b2*11-6+;

HIDE SMILES / InChI

Molecular Formula Ca
Molecular Weight 40.078
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C9H8N3O3
Molecular Weight 206.1781
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:01:52 GMT 2023
Edited
by admin
on Fri Dec 15 16:01:52 GMT 2023
Record UNII
M4Q640072Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PYRUVIC ACID CALCIUM ISONIAZID
Common Name English
ISONICOTINIC ACID, (1-CARBOXYETHYLIDENE)HYDRAZIDE CALCIUM SALT (2:1)
Common Name English
PYRUVIC ACID CALCIUM ISONIAZONE
Common Name English
ISONIAZID CALCIUM PYRUVINATE [JAN]
Common Name English
PYRUVIC ACID CALCIUM ISONIAZID ANHYDROUS
Common Name English
Isoniazid Calcium Pyruvinate [WHO-DD]
Common Name English
ISONIAZID CALCIUM PYRUVINATE
JAN   WHO-DD  
Common Name English
4-PYRIDINECARBOXYLIC ACID, (1-CARBOXYETHYLIDENE)HYDRAZIDE CALCIUM SALT (2:1)
Common Name English
ISONIAZID CALCIUM PYRUVATE
Common Name English
4-PYRIDINECARBOXYLIC ACID, 2-(1-CARBOXYETHYLIDENE)HYDRAZIDE, CALCIUM SALT (2:1)
Common Name English
Code System Code Type Description
SMS_ID
100000138192
Created by admin on Fri Dec 15 16:01:52 GMT 2023 , Edited by admin on Fri Dec 15 16:01:52 GMT 2023
PRIMARY
PUBCHEM
71468
Created by admin on Fri Dec 15 16:01:52 GMT 2023 , Edited by admin on Fri Dec 15 16:01:52 GMT 2023
PRIMARY
FDA UNII
M4Q640072Z
Created by admin on Fri Dec 15 16:01:52 GMT 2023 , Edited by admin on Fri Dec 15 16:01:52 GMT 2023
PRIMARY
ChEMBL
CHEMBL2111041
Created by admin on Fri Dec 15 16:01:52 GMT 2023 , Edited by admin on Fri Dec 15 16:01:52 GMT 2023
PRIMARY
CAS
3428-05-5
Created by admin on Fri Dec 15 16:01:52 GMT 2023 , Edited by admin on Fri Dec 15 16:01:52 GMT 2023
PRIMARY
EVMPD
SUB77586
Created by admin on Fri Dec 15 16:01:52 GMT 2023 , Edited by admin on Fri Dec 15 16:01:52 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE