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Details

Stereochemistry ACHIRAL
Molecular Formula C7H7N4O2.Na
Molecular Weight 202.1458
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THEOPHYLLINE SODIUM

SMILES

[Na+].CN1C2=C(N=C[N-]2)C(=O)N(C)C1=O

InChI

InChIKey=QVGLHVDBDYLFON-UHFFFAOYSA-M
InChI=1S/C7H8N4O2.Na/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;/h3H,1-2H3,(H,8,9,12);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
THEOPHYLLINE SODIUM
Systematic Name English
1,3-DIMETHYLXANTHINE SODIUM SALT
Common Name English
SODIUM THEOPHYLLINATE
Systematic Name English
1H-PURINE-2,6-DIONE, 3,9-DIHYDRO-1,3-DIMETHYL-, SODIUM SALT (1:1)
Systematic Name English
THEOPHYLLINE, SODIUM SALT
Common Name English
SODIUM THEOPHYLLINE
Systematic Name English
Code System Code Type Description
CAS
3485-82-3
Created by admin on Fri Dec 15 15:56:38 UTC 2023 , Edited by admin on Fri Dec 15 15:56:38 UTC 2023
PRIMARY
PUBCHEM
12765429
Created by admin on Fri Dec 15 15:56:38 UTC 2023 , Edited by admin on Fri Dec 15 15:56:38 UTC 2023
PRIMARY
ECHA (EC/EINECS)
222-472-9
Created by admin on Fri Dec 15 15:56:38 UTC 2023 , Edited by admin on Fri Dec 15 15:56:38 UTC 2023
PRIMARY
FDA UNII
5OIB3Y3T0J
Created by admin on Fri Dec 15 15:56:38 UTC 2023 , Edited by admin on Fri Dec 15 15:56:38 UTC 2023
PRIMARY
EPA CompTox
DTXSID90890578
Created by admin on Fri Dec 15 15:56:38 UTC 2023 , Edited by admin on Fri Dec 15 15:56:38 UTC 2023
PRIMARY