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more general categories information about this item 05. Industrial Uses 05. Industrial Uses pharmaceutical [CHEBI:52217] (1978) drug [CHEBI:23888] (1930) neuromuscular agent [CHEBI:51372] (51) muscle relaxant [CHEBI:51371] (47) dantrolene sodium hemiheptahydrate [CHEBI:184644] (1) 08. Chemical Category 08. Chemical Category polyatomic entity [CHEBI:36357] (18777) heteroatomic molecular entity [CHEBI:37577] (13672) addition compound [CHEBI:35504] (113) hydrate [CHEBI:35505] (111) dantrolene sodium hemiheptahydrate [CHEBI:184644] (1) ChEBI Compound Accession Identifier: [CHEBI:184644] ChEBI Compound Description: A hydrate which is the hemiheptahydrate of anhydrous dantrolene sodium. ChEBI Compound Identification Number: 184644 ChEBI InChI Value: "InChI=1S/2C14H10N4O5.2Na.7H2O/c2*19-13-8-17(14(20)16-13)15-7-11-5-6-12(23-11)9-1-3-10(4-2-9)18(21)22;;;;;;;;;/h2*1-7H,8H2,(H,16,19,20);;;7*1H2/q;;2*+1;;;;;;;/p-2/b2*15-7+;;;;;;;;;" ChEBI InChIKey Value: LTWQNYPDAUSXBC-CDJGKPBYSA-L ChEBI Compound Name: dantrolene sodium hemiheptahydrate ChEBI SMILES Value: O.O.O.O.O.O.O.[Na+].[Na+].[O-][N+](=O)c1ccc(cc1)-c1ccc(\C=N\N2CC(=O)[N-]C2=O)o1.[O-][N+](=O)c1ccc(cc1)-c1ccc(\C=N\N2CC(=O)[N-]C2=O)o1 ChEBI Substance ID: 85383553 ChEBI URL: ChEBI:184644 ChemSpider ID: 7843345 Ontomatica Chemical Accession Key (OnChAKey): LTWQNYPDAUSXBC_CDJGKPBYSA_L_000_000000 PubChem Compound ID: 9568637
