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Details

Stereochemistry ACHIRAL
Molecular Formula C9H9N4O4.Na
Molecular Weight 260.1819
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACEFYLLINE SODIUM

SMILES

[Na+].CN1C2=C(N(CC([O-])=O)C=N2)C(=O)N(C)C1=O

InChI

InChIKey=MSFVZSOKOXZSME-UHFFFAOYSA-M
InChI=1S/C9H10N4O4.Na/c1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15;/h4H,3H2,1-2H3,(H,14,15);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C9H9N4O4
Molecular Weight 237.1922
Charge -1
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 Sat Dec 16 01:30:14 UTC 2023
Edited
by admin
on Sat Dec 16 01:30:14 UTC 2023
Record UNII
WA8729994I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACEFYLLINE SODIUM
WHO-DD  
Common Name English
ACEFYLLINE SODIUM SALT
MI  
Common Name English
7H-PURINE-7-ACETIC ACID, 1,2,3,6-TETRAHYDRO-1,3-DIMETHYL-2,6-DIOXO-, SODIUM SALT (1:1)
Common Name English
Acefylline sodium [WHO-DD]
Common Name English
ACEFYLLINE SODIUM SALT [MI]
Common Name English
STENOFILLINA
Common Name English
SODIUM THEOPHYLLINE-7-ACETATE
Systematic Name English
AMINODAL
Common Name English
Code System Code Type Description
CAS
837-27-4
Created by admin on Sat Dec 16 01:30:14 UTC 2023 , Edited by admin on Sat Dec 16 01:30:14 UTC 2023
PRIMARY
MERCK INDEX
m1295
Created by admin on Sat Dec 16 01:30:14 UTC 2023 , Edited by admin on Sat Dec 16 01:30:14 UTC 2023
PRIMARY Merck Index
FDA UNII
WA8729994I
Created by admin on Sat Dec 16 01:30:14 UTC 2023 , Edited by admin on Sat Dec 16 01:30:14 UTC 2023
PRIMARY
PUBCHEM
23677981
Created by admin on Sat Dec 16 01:30:14 UTC 2023 , Edited by admin on Sat Dec 16 01:30:14 UTC 2023
PRIMARY
ECHA (EC/EINECS)
212-652-5
Created by admin on Sat Dec 16 01:30:14 UTC 2023 , Edited by admin on Sat Dec 16 01:30:14 UTC 2023
PRIMARY
EPA CompTox
DTXSID001003699
Created by admin on Sat Dec 16 01:30:14 UTC 2023 , Edited by admin on Sat Dec 16 01:30:14 UTC 2023
PRIMARY
SMS_ID
300000037354
Created by admin on Sat Dec 16 01:30:14 UTC 2023 , Edited by admin on Sat Dec 16 01:30:14 UTC 2023
PRIMARY
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PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY