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Details

Stereochemistry ACHIRAL
Molecular Formula 2C9H7O4.CH4N2O.Ca
Molecular Weight 458.432
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARBASPIRIN CALCIUM

SMILES

[Ca++].NC(N)=O.CC(=O)OC1=C(C=CC=C1)C([O-])=O.CC(=O)OC2=C(C=CC=C2)C([O-])=O

InChI

InChIKey=VYMUGTALCSPLDM-UHFFFAOYSA-L
InChI=1S/2C9H8O4.CH4N2O.Ca/c2*1-6(10)13-8-5-3-2-4-7(8)9(11)12;2-1(3)4;/h2*2-5H,1H3,(H,11,12);(H4,2,3,4);/q;;;+2/p-2

HIDE SMILES / InChI
Molecular Formula CH4N2O
Molecular Weight 60.0553
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
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 C9H7O4
Molecular Weight 179.1495
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:20:36 UTC 2023
Edited
by admin
on Fri Dec 15 15:20:36 UTC 2023
Record UNII
N667F17JP1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARBASPIRIN CALCIUM
USAN  
USAN  
Official Name English
carbasalate calcium [INN]
Common Name English
CALCIUM ACETYLSALICYLATE COMPLEX WITH UREA
MI  
Common Name English
CALCIUM ACETYLSALICYLATE CARBAMIDE
Common Name English
CALCIUM CARBASPIRIN
Common Name English
CALCIUM ACETYLSALICYLATE COMPLEX WITH UREA [MI]
Common Name English
CARBASALATE CALCIUM [MART.]
Common Name English
Salicylic acid acetate calcium salt, compound with urea (1:1) complex
Common Name English
CARBASPIRIN CALCIUM [USAN]
Common Name English
Carbasalate calcium [WHO-DD]
Common Name English
CARBASALATE CALCIUM [EP MONOGRAPH]
Common Name English
CARBASALATE CALCIUM
EP   INN   MART.   WHO-DD  
INN  
Official Name English
BENZOIC ACID, 2-(ACETYLOXY)-, CALCIUM SALT, COMPD. WITH UREA (1:1)
Common Name English
Classification Tree Code System Code
WHO-ATC N02BA15
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
NCI_THESAURUS C257
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
WHO-VATC QB01AC08
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
WHO-VATC QN02BA65
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
WHO-VATC QN02BA15
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
WHO-ATC B01AC08
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID90206099
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
MESH
C002942
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
DRUG BANK
DB13612
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
MERCK INDEX
m2920
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
227-273-0
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
DRUG CENTRAL
4387
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
FDA UNII
N667F17JP1
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
EVMPD
SUB06117MIG
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
NCI_THESAURUS
C82300
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
CAS
5749-67-7
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
SMS_ID
100000081316
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
WIKIPEDIA
Carbasalate calcium
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
PUBCHEM
21975
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
INN
1656
Created by admin on Fri Dec 15 15:20:36 UTC 2023 , Edited by admin on Fri Dec 15 15:20:36 UTC 2023
PRIMARY
Related Record Type Details
Structure of ASPIRIN
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of SALSALATE
IMPURITY -> PARENT
Structure of ACETYLSALICYLSALICYLIC ACID
IMPURITY -> PARENT
Structure of ASPIRIN ANHYDRIDE
IMPURITY -> PARENT
Structure of Salicylic acid
IMPURITY -> PARENT
Related Record Type Details
Structure of ASPIRIN
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