(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[4-[[4-(methylamino)phenyl]diazenyl]phenyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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![(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[4-[[4-(methylamino)phenyl]diazenyl]phenyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7d404987d201403485fb850d7f5b11aa.png "(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[4-[[4-(methylamino)phenyl]diazenyl]phenyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid")
(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[4-[[4-(methylamino)phenyl]diazenyl]phenyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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CAS No:
71259-45-5
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Formula:
C23H28N6O6S
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Chemical Name:
(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[4-[[4-(methylamino)phenyl]diazenyl]phenyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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Synonyms:
3-(glutathion-S-yl)-N-methyl-4-aminoazobenzene;3-GSMAB;3-Gsmab;3-(Glutathion-S-yl)-N-methyl-4-aminoazobenzene;71259-45-5;Glycine, N-(N-L-gamma-glutamyl-S-(4-((4-(methylamino)phenyl)azo)phenyl)-L-cysteinyl)-
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CAS No:
(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[4-[[4-(methylamino)phenyl]diazenyl]phenyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Basic Attributes
516.6 g/mol
516.17910381 g/mol
Computed Properties
Molecular Weight:516.6
XLogP3:-0.8
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:14
Exact Mass:516.17910381
Monoisotopic Mass:516.17910381
Topological Polar Surface Area:221
Heavy Atom Count:36
Complexity:768
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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