ICF

1-CHLORO-2,2,2-TRIFLUOROETHYL DIFLUOROMETHYL ETHER

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is present as a standalone ligand in 2 entries

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Chemical Component Summary
Name	1-CHLORO-2,2,2-TRIFLUOROETHYL DIFLUOROMETHYL ETHER
Synonyms	ISOFLURANE
Identifiers	(2S)-2-chloro-2-(difluoromethoxy)-1,1,1-trifluoro-ethane
Formula	C₃ H₂ Cl F₅ O
Molecular Weight	184.492
Type	NON-POLYMER
Isomeric SMILES	[C@H](C(F)(F)F)(OC(F)F)Cl
InChI	InChI=1S/C3H2ClF5O/c4-1(3(7,8)9)10-2(5)6/h1-2H/t1-/m1/s1
InChIKey	PIWKPBJCKXDKJR-PVQJCKRUSA-N

Chemical Details
Formal Charge	0
Atom Count	12
Chiral Atom Count	1
Bond Count	11
Aromatic Bond Count	0

Drug Info: DrugBank

DrugBank ID	DB00753
Name	Isoflurane
Groups	approved vet_approved
Description	A stable, non-explosive inhalation anesthetic, relatively free from significant side effects.
Synonyms	Isofluranum Isoflurane 1-chloro-2,2,2-trifluoroethyl difluoromethyl ether Isoflurano
Brand Names	Forane Forane Liq Inh Isoflurane Terrell Isoflurane USP
Indication	For induction and maintenance of general anesthesia.
Categories	Agents that produce hypertension Agents that reduce seizure threshold Anesthetics Anesthetics, General Anesthetics, Inhalation Anticholinergic Agents Central Nervous System Agents Central Nervous System Depressants Cytochrome P-450 CYP2B6 Inducers Cytochrome P-450 CYP2B6 Inducers (strength unknown) Cytochrome P-450 CYP2B6 Substrates Cytochrome P-450 CYP2E1 Substrates Cytochrome P-450 Enzyme Inducers Cytochrome P-450 Substrates Ethers Hydrocarbons, Halogenated Hypotensive Agents Methyl Ethers Nervous System Nicotinic Antagonists Potential QTc-Prolonging Agents QTc Prolonging Agents
ATC-Code	N01AB06
CAS number	26675-46-7

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Gamma-aminobutyric acid receptor subunit alpha-1	MRKSPGLSDCLWAWILLLSTLTGRSYGQPSLQDELKDNTTVFTRILDRLL...	unknown	agonist
Calcium-transporting ATPase type 2C member 1	MKVARFQKIPNGENETMIPVLTSKKASELPVSEVASILQADLQNGLNKCE...	unknown	inhibitor
Glycine receptor subunit alpha-1	MYSFNTLRLYLWETIVFFSLAASKEAEAARSAPKPMSPSDFLDKLMGRTS...	unknown	agonist
Glutamate receptor 1	MQHIFAFFCTGFLGAVVGANFPNNIQIGGLFPNQQSQEHAAFRFALSQLT...	unknown	antagonist
Potassium voltage-gated channel subfamily A member 1	MTVMSGENVDEASAAPGHPQDGSYPRQADHDDHECCERVVINISGLRFET...	unknown	inducer
GABA(A) Receptor	MRKSPGLSDCLWAWILLLSTLTGRSYGQPSLQDELKDNTTVFTRILDRLL...	unknown	positive allosteric modulator
ATP synthase subunit delta, mitochondrial	MLPAALLRRPGLGRLVRHARAYAEAAAAPAAASGPNQMSFTFASPTQVFF...	unknown	unknown
Calmodulin	MADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQ...	unknown	other/unknown
Neuronal acetylcholine receptor subunit alpha-4	MELGGPGAPRLLPPLLLLLGTGLLRASSHVETRAHAEERLLKKLFSGYNK...	unknown	antagonist
Neuronal acetylcholine receptor subunit beta-2	MARRCGPVALLLGFGLLRLCSGVWGTDTEERLVEHLLDPSRYNKLIRPAT...	unknown	antagonist
Cytochrome P450 2B6	MELSVLLFLALLTGLLLLLVQRHPNTHDRLPPGPRPLPLLGNLLQMDRRG...	unknown	substrate,inducer
NADH-ubiquinone oxidoreductase chain 1	MPMANLLLLIVPILIAMAFLMLTERKILGYMQLRKGPNVVGPYGLLQPFA...	unknown	inhibitor
Cytochrome P450 2E1	MSALGVTVALLVWAAFLLLVSMWRQVHSSWNLPPGPFPLPIIGNLFQLEL...	unknown	substrate
Serum albumin	MKWVTFISLLFLFSSAYSRGVFRRDAHKSEVAHRFKDLGEENFKALVLIA...	unknown
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Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682