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Home > Encyclopedia > 4-[2-[[(2R)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-2-carboxyethyl]disulfanyl]ethylamino]pyridine-2,6-dicarboxylic acid

4-[2-[[(2R)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-2-carboxyethyl]disulfanyl]ethylamino]pyridine-2,6-dicarboxylic acid

4-[2-[[(2R)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-2-carboxyethyl]disulfanyl]ethylamino]pyridine-2,6-dicarboxylic acid structure

4-[2-[[(2R)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-2-carboxyethyl]disulfanyl]ethylamino]pyridine-2,6-dicarboxylic acid 

structure
  • CAS No:

    88090-55-5

  • Formula:

    C18H25N5O8S2

  • Chemical Name:

    4-[2-[[(2R)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-2-carboxyethyl]disulfanyl]ethylamino]pyridine-2,6-dicarboxylic acid

  • Synonyms:

    Ala-Ala-Cys-MEPDA;alanylalanyl-S-(4-(N-(2-thioethyl))aminopyridine-2,6-dicarboxylic acid)cysteine;88090-55-5;Ala-ala-cys-mepda;DTXSID901007931;Alanylalanyl-S-(4-(N-(2-thioethyl))aminopyridine-2,6-dicarboxylic acid)cysteine;4-[(2-{[2-({2-[(2-Amino-1-hydroxypropylidene)amino]-1-hydroxypropylidene}amino)-2-carboxyethyl]disulfanyl}ethyl)amino]pyridine-2,6-dicarboxylic acid;L-Alanine, N-(N-L-alanyl-L-alanyl)-3-((2-((2,6-dicarboxy-4-pyridinyl)amino)ethyl)dithio)-

4-[2-[[(2R)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-2-carboxyethyl]disulfanyl]ethylamino]pyridine-2,6-dicarboxylic acid Basic Attributes

503.6 g/mol

503.11445512 g/mol

Characteristics

272 Ų

Drug Information

Ala-Ala-Cys-MEPDA

Computed Properties

Molecular Weight:503.6
XLogP3:-2.9
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:14
Exact Mass:503.11445512
Monoisotopic Mass:503.11445512
Topological Polar Surface Area:272
Heavy Atom Count:33
Complexity:706
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 4-[2-[[(2R)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-2-carboxyethyl]disulfanyl]ethylamino]pyridine-2,6-dicarboxylic acid

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