(2S)-2-amino-5-[[(2R)-2-amino-3-[5-[(2S)-2-amino-2-carboxyethyl]-2,3-dihydroxyphenyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid
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![(2S)-2-amino-5-[[(2R)-2-amino-3-[5-[(2S)-2-amino-2-carboxyethyl]-2,3-dihydroxyphenyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6e56d1f472384a35959a760d0b82e591.png "(2S)-2-amino-5-[[(2R)-2-amino-3-[5-[(2S)-2-amino-2-carboxyethyl]-2,3-dihydroxyphenyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid")
(2S)-2-amino-5-[[(2R)-2-amino-3-[5-[(2S)-2-amino-2-carboxyethyl]-2,3-dihydroxyphenyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid
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CAS No:
55136-58-8
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Formula:
C19H26N4O10S
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Chemical Name:
(2S)-2-amino-5-[[(2R)-2-amino-3-[5-[(2S)-2-amino-2-carboxyethyl]-2,3-dihydroxyphenyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid
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Synonyms:
5-S-glutathionedopa;glutathionedopa;glutathionyldopa;Glutathionedopa;55136-58-8;Glutathionyldopa;5-S-Glutathionedopa;DTXSID30970489;S-[5-(2-Amino-2-carboxyethyl)-2,3-dihydroxyphenyl]cysteinyl-N-gamma-glutamylglycine;(2S)-2-amino-5-[[(2R)-2-amino-3-[5-[(2S)-2-amino-2-carboxyethyl]-2,3-dihydroxyphenyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid;Glycine, N-(S-(5-(2-amino-2-carboxyethyl)-2,3-dihydroxyphenyl)-N-L-gamma-glutamyl-L-cysteinyl)-, (S)-
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CAS No:
(2S)-2-amino-5-[[(2R)-2-amino-3-[5-[(2S)-2-amino-2-carboxyethyl]-2,3-dihydroxyphenyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid Basic Attributes
502.5 g/mol
502.13696421 g/mol
Computed Properties
Molecular Weight:502.5
XLogP3:-9.2
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:13
Exact Mass:502.13696421
Monoisotopic Mass:502.13696421
Topological Polar Surface Area:293
Heavy Atom Count:34
Complexity:769
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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