ChemicalBook--->CAS DataBase List--->7279-75-6

7279-75-6

7279-75-6 Structure

7279-75-6 Structure
IdentificationBack Directory
[Name]

4-[1-HYDROXY-2-([1-METHYLETHYL]AMINO)BUTYL]-1,2-BENZENEDIOL METHANESULFONATE
[CAS]

7279-75-6
[Synonyms]

Salmeterol-d
isoetarine mesilate
ISOETHARINE MESYLATE
ISOETHARINE MESYLATE SALT
SOYAGMVKMXZVNZ-UHFFFAOYSA-N
4-[1-HYDROXY-2-[(1-METHYLETHYL)AMINO]BUTYL]-1,2-BENZENEDIOL MESYLATE SALT
4-[1-HYDROXY-2-([1-METHYLETHYL]AMINO)BUTYL]-1,2-BENZENEDIOL METHANESULFONATE
4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol,methanesulfonic acid
Adrenergic Receptor,Beta Receptor,Inhibitor,Isoetarine,catechol-like,β-adrenergic Receptors Agonist,emphysema,Isoetharine mesylate salt,inhibit,COMT,bronchodilator,bronchitis,Isoetharine
[EINECS(EC#)]

230-695-8
[Molecular Formula]

C14H25NO6S
[MDL Number]

MFCD00133422
[MOL File]

7279-75-6.mol
[Molecular Weight]

335.42
Chemical PropertiesBack Directory
[storage temp. ]

2-8°C
[form ]

Solid
[color ]

White to off-white
[InChI]

1S/C13H21NO3.CH4O3S/c1-4-10(14-8(2)3)13(17)9-5-6-11(15)12(16)7-9;1-5(2,3)4/h5-8,10,13-17H,4H2,1-3H3;1H3,(H,2,3,4)
[InChIKey]

SOYAGMVKMXZVNZ-UHFFFAOYSA-N
[SMILES]

CS(O)(=O)=O.CCC(NC(C)C)C(O)c1ccc(O)c(O)c1
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

20/21/22
[Safety Statements ]

36
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

chelating agent
[Uses]

Isoetharine Mesylate Salt is a β-adrenergic receptor agonist. Also, it is pregnane X receptor (PXR) activator capable of upregulating CYP450 expression.
[Brand name]

Bronk ometer (Sanofi Aventis).
[Biological Activity]

Isoetharine is an agonist for β-adrenergic receptors and is a bronchodilator. It is a catecholic drug metabolized by sulfotransferases and is present in human urine and plasma as a sulfated metabolite. Catechol O-methyltransferase (COMT) also mediates the methylation of isoetharine in the metabolic conjugation pathway.
[in vivo]

Isoetharine mesylate inhibits melanin deposition with the AC50 value of 5.10 mM and complete inhibition of pigment production at 7.50 mM in the zebrafish larvae model[2].

[IC 50]

β adrenergic receptor
Spectrum DetailBack Directory
[Spectrum Detail]

4-[1-HYDROXY-2-([1-METHYLETHYL]AMINO)BUTYL]-1,2-BENZENEDIOL METHANESULFONATE(7279-75-6)1HNMR
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