2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-hydroxyanilino)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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![2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-hydroxyanilino)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/080b374e4d6d416a9bc629902909a3dd.png "2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-hydroxyanilino)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid")
2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-hydroxyanilino)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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CAS No:
89519-14-2
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Formula:
C18H24N4O8S
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Chemical Name:
2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-hydroxyanilino)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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Synonyms:
89519-14-2;NSC381988;DTXSID60321804;NSC-381988;2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-hydroxyanilino)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid;DS-012925;2-Amino-4-[[1-(carboxymethylcarbamoyl)-2-[(4-hydroxyphenyl)carbamoylmethylsulfanyl]ethyl]carbamoyl]butanoic acid
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CAS No:
2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-hydroxyanilino)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Basic Attributes
456.5 g/mol
456.13148491 g/mol
381988
DTXSID60321804
Computed Properties
Molecular Weight:456.5
XLogP3:-3.6
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:13
Exact Mass:456.13148491
Monoisotopic Mass:456.13148491
Topological Polar Surface Area:233
Heavy Atom Count:31
Complexity:655
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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