(2R)-2-[[(4S)-4-[(2-aminoacetyl)amino]-4-carboxybutanoyl]amino]-3-hydroxy-3-(hydroxymethyl)-4-(4-nitrophenoxy)-2-(sulfanylmethyl)butanoic acid
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![(2R)-2-[[(4S)-4-[(2-aminoacetyl)amino]-4-carboxybutanoyl]amino]-3-hydroxy-3-(hydroxymethyl)-4-(4-nitrophenoxy)-2-(sulfanylmethyl)butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6f76bdeae4124df1b0fb65f78197dbad.png "(2R)-2-[[(4S)-4-[(2-aminoacetyl)amino]-4-carboxybutanoyl]amino]-3-hydroxy-3-(hydroxymethyl)-4-(4-nitrophenoxy)-2-(sulfanylmethyl)butanoic acid")
(2R)-2-[[(4S)-4-[(2-aminoacetyl)amino]-4-carboxybutanoyl]amino]-3-hydroxy-3-(hydroxymethyl)-4-(4-nitrophenoxy)-2-(sulfanylmethyl)butanoic acid
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CAS No:
134564-85-5
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Formula:
C19H26N4O11S
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Chemical Name:
(2R)-2-[[(4S)-4-[(2-aminoacetyl)amino]-4-carboxybutanoyl]amino]-3-hydroxy-3-(hydroxymethyl)-4-(4-nitrophenoxy)-2-(sulfanylmethyl)butanoic acid
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Synonyms:
3-(4-nitrophenoxy)-2-(S-glutathionyl)-1-propanol;3-NPGP;134564-85-5;3-Npgp;DTXSID80928677;3-(4-Nitrophenoxy)-2-(S-glutathionyl)-1-propanol;(2R)-2-[[(4S)-4-[(2-aminoacetyl)amino]-4-carboxybutanoyl]amino]-3-hydroxy-3-(hydroxymethyl)-4-(4-nitrophenoxy)-2-(sulfanylmethyl)butanoic acid;L-Cysteine, 2-(1,2-dihydroxy-1-((4-nitrophenoxy)methyl)ethyl)-N-(N-glycyl-L-gamma-glutamyl)-;N-(2-Amino-1-hydroxyethylidene)-5-{[2-carboxy-3-hydroxy-3-(hydroxymethyl)-4-(4-nitrophenoxy)-1-sulfanylbutan-2-yl]imino}-5-hydroxynorvaline
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CAS No:
(2R)-2-[[(4S)-4-[(2-aminoacetyl)amino]-4-carboxybutanoyl]amino]-3-hydroxy-3-(hydroxymethyl)-4-(4-nitrophenoxy)-2-(sulfanylmethyl)butanoic acid Basic Attributes
518.5 g/mol
518.13187883 g/mol
Computed Properties
Molecular Weight:518.5
XLogP3:-4.7
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:14
Exact Mass:518.13187883
Monoisotopic Mass:518.13187883
Topological Polar Surface Area:255
Heavy Atom Count:35
Complexity:787
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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