2-[[2-amino-3-[[2-amino-3-[(1-carboxy-2-methylpropyl)amino]-3-oxopropyl]disulfanyl]propanoyl]amino]-3-methylbutanoic acid
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![2-[[2-amino-3-[[2-amino-3-[(1-carboxy-2-methylpropyl)amino]-3-oxopropyl]disulfanyl]propanoyl]amino]-3-methylbutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3ba5cef45234490ca50bcd441ff9a668.png "2-[[2-amino-3-[[2-amino-3-[(1-carboxy-2-methylpropyl)amino]-3-oxopropyl]disulfanyl]propanoyl]amino]-3-methylbutanoic acid")
2-[[2-amino-3-[[2-amino-3-[(1-carboxy-2-methylpropyl)amino]-3-oxopropyl]disulfanyl]propanoyl]amino]-3-methylbutanoic acid
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CAS No:
21141-84-4
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Formula:
C16H30N4O6S2
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Chemical Name:
2-[[2-amino-3-[[2-amino-3-[(1-carboxy-2-methylpropyl)amino]-3-oxopropyl]disulfanyl]propanoyl]amino]-3-methylbutanoic acid
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Synonyms:
N-(2-Amino-3-((2-amino-3-((1-carboxy-2-methylpropyl)amino)-3-oxopropyl)dithio)propanoyl)valine; (2R)-2-[[(2R)-2-amino-3-[[(2R)-2-amino-3-[[(1R)-1-carboxy-2-methylpropyl]amino]-3-oxopropyl]disulfanyl]propanoyl]amino]-3-methylbutanoic acid; 2-[[2-amino-3-[[2-amino-3-[(1-hydroxy-3-methyl-1-oxobutan-2-yl)amino]-3-oxopropyl]disulfanyl]propanoyl]amino]-3-methylbutanoic acid; L-Cystinyl-bis-L-valin;
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CAS No:
2-[[2-amino-3-[[2-amino-3-[(1-carboxy-2-methylpropyl)amino]-3-oxopropyl]disulfanyl]propanoyl]amino]-3-methylbutanoic acid Basic Attributes
438.56300
438.16067704 g/mol
333715
Characteristics
235.44000
1.65560
1.323g/cm3
748.5ºC at 760mmHg
406.5ºC
1.574
-15ºC
1.61E-24mmHg at 25°C
Computed Properties
Molecular Weight:438.6
XLogP3:-4.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:13
Exact Mass:438.16067704
Monoisotopic Mass:438.16067704
Topological Polar Surface Area:235
Heavy Atom Count:28
Complexity:513
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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