| 2D Structure | |
| CID | 10221451 |
| IUPAC Name | disodium;1,3-dimethyl-2-oxopurin-6-olate;acetate |
| InChI | InChI=1S/C7H8N4O2.C2H4O2.2Na/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;1-2(3)4;;/h3,12H,1-2H3;1H3,(H,3,4);;/q;;2*+1/p-2 |
| InChI Key | KXRNMXPUTQVFOA-UHFFFAOYSA-L |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C9H10N4Na2O4 |
| Molecular Weight | 284.18 |
| synonyms | ['8002-89-9', 'Theocin soluble', 'Acet-theocin sodium', 'Theophylline sodium acetate', 'Theophylline, sodium acetate', '75YK6TWH9F', 'Theophyllinum natrium aceticum', 'Theophylline sodium acetate [NF]', 'Theophyllinum natrium aceticum [German]', 'THEOPHYLLINE SODIUM ACETATE [MI]', 'THEOPHYLLINE SODIUM ACETATE [WHO-DD]', 'THEOPHYLLINE SODIUM ACETATE ANHYDROUS', 'Acetic acid, sodium salt, mixt. with 3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione sodium salt', 'ACETIC ACID, SODIUM SALT (1:1), MIXT. WITH 3,7-DIHYDRO-1,3-DIMETHYL-1H-PURINE-2,6-DIONE SODIUM SALT', 'Theophylline sodium acetate (JAN)', 'THEOPHYLLINE SODIUM ACETATE [JAN]', '88AO1K4HJ3', 'THEOPHYLLINE SODIUM ACETATE HYDRATE', 'THEOPHYLLINE SODIUM ACETATE MONOHYDRATE', 'Theophyllol ,', 'disodium 1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-ide acetate', 'MFCD00145398', 'UNII-75YK6TWH9F', 'C9H10N4Na2O4', 'SCHEMBL29558861', 'IAA00289', 'DA-68138', 'T0180', 'Q27266419'] |
From Pubchem