5-O-benzyl 1-O-phenacyl (2S)-2-[[(2S)-2-[[(2S)-2-[(1-ethoxy-1-oxobut-3-en-2-yl)amino]propanoyl]amino]-5-oxo-5-phenylmethoxypentanoyl]amino]pentanedioate
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![5-O-benzyl 1-O-phenacyl (2S)-2-[[(2S)-2-[[(2S)-2-[(1-ethoxy-1-oxobut-3-en-2-yl)amino]propanoyl]amino]-5-oxo-5-phenylmethoxypentanoyl]amino]pentanedioate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d30611a3bfff40258532440567359725.png "5-O-benzyl 1-O-phenacyl (2S)-2-[[(2S)-2-[[(2S)-2-[(1-ethoxy-1-oxobut-3-en-2-yl)amino]propanoyl]amino]-5-oxo-5-phenylmethoxypentanoyl]amino]pentanedioate")
5-O-benzyl 1-O-phenacyl (2S)-2-[[(2S)-2-[[(2S)-2-[(1-ethoxy-1-oxobut-3-en-2-yl)amino]propanoyl]amino]-5-oxo-5-phenylmethoxypentanoyl]amino]pentanedioate
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CAS No:
38236-39-4
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Formula:
C41H47N3O11
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Chemical Name:
5-O-benzyl 1-O-phenacyl (2S)-2-[[(2S)-2-[[(2S)-2-[(1-ethoxy-1-oxobut-3-en-2-yl)amino]propanoyl]amino]-5-oxo-5-phenylmethoxypentanoyl]amino]pentanedioate
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Synonyms:
Phenacyl N-(1-ethoxycarbonyl-2-propenyl)alanyl-gamma-benzylglutamyl-gamma-benzylglutamate;38236-39-4;L-Glutamic acid, N-(N-(N-(1-(ethoxycarbonyl)-2-propenyl)-L-alanyl)-L-alpha-glutamyl)-, 1-(2-oxo-2-phenylethyl) 5,5'-bis(phenylmethyl) ester
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CAS No:
5-O-benzyl 1-O-phenacyl (2S)-2-[[(2S)-2-[[(2S)-2-[(1-ethoxy-1-oxobut-3-en-2-yl)amino]propanoyl]amino]-5-oxo-5-phenylmethoxypentanoyl]amino]pentanedioate Basic Attributes
757.8 g/mol
757.32105932 g/mol
Computed Properties
Molecular Weight:757.8
XLogP3:4.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:27
Exact Mass:757.32105932
Monoisotopic Mass:757.32105932
Topological Polar Surface Area:193
Heavy Atom Count:55
Complexity:1270
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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