(2S,3R)-2-[[2-[[2-(5,9-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
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(2S,3R)-2-[[2-[[2-(5,9-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
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CAS No:
956041-04-6
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Formula:
C29H30N2O7
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Chemical Name:
(2S,3R)-2-[[2-[[2-(5,9-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
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Synonyms:
ZINC2122327;STL530901;AKOS030503848;MCULE-3640994740;N-[(5,9-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetyl]glycyl-L-isoleucine;956041-04-6
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CAS No:
(2S,3R)-2-[[2-[[2-(5,9-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid Basic Attributes
518.6 g/mol
518.20530130 g/mol
Computed Properties
Molecular Weight:518.6
XLogP3:4.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:518.20530130
Monoisotopic Mass:518.20530130
Topological Polar Surface Area:135
Heavy Atom Count:38
Complexity:957
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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