2-[[1-[2-[(2-amino-3-hydroxybutanoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]acetic acid;2,2,2-trifluoroacetic acid
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![2-[[1-[2-[(2-amino-3-hydroxybutanoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]acetic acid;2,2,2-trifluoroacetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/55b1387982c34da193848955bf711b4b.png "2-[[1-[2-[(2-amino-3-hydroxybutanoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]acetic acid;2,2,2-trifluoroacetic acid")
2-[[1-[2-[(2-amino-3-hydroxybutanoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]acetic acid;2,2,2-trifluoroacetic acid
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CAS No:
5616-86-4
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Formula:
C19H31F3N4O8
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Chemical Name:
2-[[1-[2-[(2-amino-3-hydroxybutanoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]acetic acid;2,2,2-trifluoroacetic acid
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Synonyms:
5616-86-4;NSC89347;DTXSID20971541;NSC-89347;N-(2-Amino-1,3-dihydroxybutylidene)valylprolyl-N-methylglycine--trifluoroacetic acid (1/1)
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CAS No:
2-[[1-[2-[(2-amino-3-hydroxybutanoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]acetic acid;2,2,2-trifluoroacetic acid Basic Attributes
500.5 g/mol
500.20939845 g/mol
89347
Computed Properties
Molecular Weight:500.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:8
Exact Mass:500.20939845
Monoisotopic Mass:500.20939845
Topological Polar Surface Area:191
Heavy Atom Count:34
Complexity:665
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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