L-Phenylalanine, N-[1-oxo-5-(1H-tetrazol-5-yl)pentyl]-L-valyl-L-valyl-(1S,3aR,6aS)-octahydrocyclopenta[c]pyrrole-1-carbonyl-3-amino-2-oxohexanoyl- (9CI)
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L-Phenylalanine, N-[1-oxo-5-(1H-tetrazol-5-yl)pentyl]-L-valyl-L-valyl-(1S,3aR,6aS)-octahydrocyclopenta[c]pyrrole-1-carbonyl-3-amino-2-oxohexanoyl- (9CI)
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CAS No:
402956-79-0
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Formula:
C39H57N9O8
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Chemical Name:
L-Phenylalanine, N-[1-oxo-5-(1H-tetrazol-5-yl)pentyl]-L-valyl-L-valyl-(1S,3aR,6aS)-octahydrocyclopenta[c]pyrrole-1-carbonyl-3-amino-2-oxohexanoyl- (9CI)
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Synonyms:
402956-79-0;DTXSID80349287;(2S)-2-{[3-({(1S,3aR,6aS)-2-[(2S)-3-Methyl-2-{[(2S)-3-methyl-2-{[5-(2H-tetrazol-5-yl)pentanoyl]amino}butanoyl]amino}butanoyl]octahydrocyclopenta[c]pyrrole-1-carbonyl}amino)-2-oxohexanoyl]amino}-3-phenylpropanoic acid (non-preferred name);L-Phenylalanine, N-[1-oxo-5-(1H-tetrazol-5-yl)pentyl]-L-valyl-L-valyl-(1S,3aR,6aS)-octahydrocyclopenta[c]pyrrole-1-carbonyl-3-amino-2-oxohexanoyl- (9CI)
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CAS No:
L-Phenylalanine, N-[1-oxo-5-(1H-tetrazol-5-yl)pentyl]-L-valyl-L-valyl-(1S,3aR,6aS)-octahydrocyclopenta[c]pyrrole-1-carbonyl-3-amino-2-oxohexanoyl- (9CI) Basic Attributes
779.9 g/mol
779.43300981 g/mol
DTXSID80349287
Computed Properties
Molecular Weight:779.9
XLogP3:4.1
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:21
Exact Mass:779.43300981
Monoisotopic Mass:779.43300981
Topological Polar Surface Area:246
Heavy Atom Count:56
Complexity:1390
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-Cyclohexene-1-carboxylic acid, 4-(1-hydroxyethyl)- (9CI)
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5-Cyclohexene-1,2,3,4-tetrol, (1R,2R,3S,4S)- (9CI) Formula
351885-25-1
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3-Cyclopentene-1,2-diol, 3-(aminomethyl)-5-methoxy-, (1R,2R,5R)-rel- (9CI) Formula
738572-47-9
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