Methionine sulfoxide
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Methionine sulfoxide
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CAS No:
62697-73-8
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Formula:
C5H11NO3S
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Chemical Name:
Methionine sulfoxide
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Synonyms:
Methionine,S-oxide;Butanoic acid,2-amino-4-(methylsulfinyl)-,(±)-;Butanoic acid,2-amino-4-(methylsulfinyl)-;Butyric acid,α-amino-γ-(methylsulfinyl)-;Methionine sulfoxide;DL-Methionine sulfoxide;dl-Methionine sulfoxide;NSC 3084;2-Amino-4-methanesulfinylbutanoic acid;2-Azaniumyl-4-methylsulfinylbutanoate;454-41-1;4241-59-2
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CAS No:
Description
Methionine sulfoxide is an oxidation product of methionine with reactive oxygen species and can be regarded as a biomarker of oxidative stress in vivo.
Methionine S-oxide is the S-oxide derivative of methionine. It is a biomarker of oxidative stress. It has a role as a biomarker and a human metabolite.
Characteristics
99.6
-1.62
1.4±0.1 g/cm3
220-230 °C
434.3±40.0 °C at 760 mmHg
216.4±27.3 °C
1.570
soluble in water and Hcl.
LD50 intraperitoneal in mouse: 4gm/kg
133.1 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]
Safety Information
NONH for all modes of transport
3
24/25
ES7120000
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
Computed Properties
Molecular Weight:165.21
XLogP3:-4.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:165.04596439
Monoisotopic Mass:165.04596439
Topological Polar Surface Area:99.6
Heavy Atom Count:10
Complexity:148
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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