(2S)-N-[2-[[(2S)-2-[[(2R)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]-1-[(2S)-2-amino-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide
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(2S)-N-[2-[[(2S)-2-[[(2R)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]-1-[(2S)-2-amino-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide
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CAS No:
127627-13-8
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Formula:
C31H42N10O8
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Chemical Name:
(2S)-N-[2-[[(2S)-2-[[(2R)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]-1-[(2S)-2-amino-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide
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Synonyms:
443C81;Tyr-Arg-Gly-(4-nitrophenyl-Phe)-ProNH2;tyrosyl-arginyl-glycyl-4-nitrophenylalanyl-prolinamide;DTXSID40925920;Tyr-arg-gly-(4-nitrophenyl-phe)-pronh2;(2S)-N-[2-[[(2S)-2-[[(2R)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]-1-[(2S)-2-amino-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide;Tyrosyl-arginyl-glycyl-4-nitrophenylalanyl-prolinamide;L-Prolinamide, D-tyrosyl-L-arginylglycyl-4-nitro-L-phenylalanyl-;4-Nitrophenylalanyl-N-{2-[(2-{[2-amino-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino}-5-carbamimidamido-1-hydroxypentylidene)amino]-1-hydroxyethylidene}prolinamide
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CAS No:
(2S)-N-[2-[[(2S)-2-[[(2R)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]-1-[(2S)-2-amino-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide Basic Attributes
682.7 g/mol
682.31870834 g/mol
Computed Properties
Molecular Weight:682.7
XLogP3:-1.4
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:15
Exact Mass:682.31870834
Monoisotopic Mass:682.31870834
Topological Polar Surface Area:307
Heavy Atom Count:49
Complexity:1190
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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