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(S)-timolol hemihydrate
A hydrate, which is the hemihydrate form of the (S)-(-) (more active) enantiomer of timolol.


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05. Industrial Uses: pharmaceutical [CHEBI:52217] > drug [CHEBI:23888] > ophthalmology drug [CHEBI:66981] > antiglaucoma drug [CHEBI:39456]
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03. Biological Effects of Specific Chemicals 
03. Biological Effects of Specific Chemicals
 pharmacological uses [CHEBI:52210] (736) 
 neurotransmitter agent [CHEBI:35942] (471) 
 adrenergic agent [CHEBI:37962] (143) 
 adrenergic antagonist [CHEBI:37887] (75) 
 beta-adrenergic antagonist [CHEBI:35530] (33) 
 (S)-timolol hemihydrate [CHEBI:60787] (1)
05. Industrial Uses 
05. Industrial Uses
 pharmaceutical [CHEBI:52217] (1978) 
 drug [CHEBI:23888] (1930) 
 antihypertensive agent [CHEBI:35674] (104) 
 (S)-timolol hemihydrate [CHEBI:60787] (1)
 ophthalmology drug [CHEBI:66981] (30) 
 antiglaucoma drug [CHEBI:39456] (28) 
 (S)-timolol hemihydrate [CHEBI:60787] (1)
 cardiovascular drug [CHEBI:35554] (162) 
 anti-arrhythmia drug [CHEBI:38070] (56) 
 (S)-timolol hemihydrate [CHEBI:60787] (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) 
 (S)-timolol hemihydrate [CHEBI:60787] (1)
ChEBI Compound Accession Identifier  [CHEBI:60787]
ChEBI Compound Description  A hydrate, which is the hemihydrate form of the (S)-(-) (more active) enantiomer of timolol.
ChEBI Compound Identification Number  60787
ChEBI InChI Value  "InChI=1S/2C13H24N4O3S.H2O/c2*1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17;/h2*10,14,18H,4-9H2,1-3H3;1H2/t2*10-;/m00./s1"
ChEBI InChIKey Value  TWBNMYSKRDRHAT-RCWTXCDDSA-N
ChEBI Compound Name  (S)-timolol hemihydrate
ChEBI SMILES Value  O.CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1.CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1
ChEBI Substance ID  104222383
ChEBI URL  ChEBI:60787
ChemSpider ID  56650
Ontomatica Chemical Accession Key (OnChAKey)  TWBNMYSKRDRHAT_RCWTXCDDSA_N_000_000000
PubChem Compound ID  62933