N-[2-[[[(2S)-2-Amino-4-(methylthio)butyl]dithio]methyl]-1-oxo-3-phenylpropyl]-L-phenylalanine phenylmethyl ester
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![N-[2-[[[(2S)-2-Amino-4-(methylthio)butyl]dithio]methyl]-1-oxo-3-phenylpropyl]-L-phenylalanine phenylmethyl ester structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ff408e1974374c44af9b53809341451a.png "N-[2-[[[(2S)-2-Amino-4-(methylthio)butyl]dithio]methyl]-1-oxo-3-phenylpropyl]-L-phenylalanine phenylmethyl ester")
N-[2-[[[(2S)-2-Amino-4-(methylthio)butyl]dithio]methyl]-1-oxo-3-phenylpropyl]-L-phenylalanine phenylmethyl ester
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CAS No:
135949-60-9
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Formula:
C31H38N2O3S3
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Chemical Name:
N-[2-[[[(2S)-2-Amino-4-(methylthio)butyl]dithio]methyl]-1-oxo-3-phenylpropyl]-L-phenylalanine phenylmethyl ester
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Synonyms:
L-Phenylalanine,N-[2-[[[(2S)-2-amino-4-(methylthio)butyl]dithio]methyl]-1-oxo-3-phenylpropyl]-,phenylmethyl ester;N-[2-[[[(2S)-2-Amino-4-(methylthio)butyl]dithio]methyl]-1-oxo-3-phenylpropyl]-L-phenylalanine phenylmethyl ester;RB101 base;203498-61-7
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CAS No:
N-[2-[[[(2S)-2-Amino-4-(methylthio)butyl]dithio]methyl]-1-oxo-3-phenylpropyl]-L-phenylalanine phenylmethyl ester Basic Attributes
582.8 g/mol
582.84
Drug Information
Compounds capable of relieving pain without the loss of CONSCIOUSNESS. (See all compounds classified as Analgesics.)|Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)
N-(2-benzyl-3-((2-amino-4-methylthio)butyl dithio)-1-oxopropyl)phenylalanine benzyl ester
Computed Properties
Molecular Weight:582.8
XLogP3:5.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:18
Exact Mass:582.20445660
Monoisotopic Mass:582.20445660
Topological Polar Surface Area:157
Heavy Atom Count:39
Complexity:680
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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