(2S)-3-methyl-2-[[2-[[2-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]butanoic acid
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![(2S)-3-methyl-2-[[2-[[2-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9d19320859cc4546a17c3b338bc66362.png "(2S)-3-methyl-2-[[2-[[2-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]butanoic acid")
(2S)-3-methyl-2-[[2-[[2-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]butanoic acid
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CAS No:
956194-25-5
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Formula:
C29H30N2O7
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Chemical Name:
(2S)-3-methyl-2-[[2-[[2-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]butanoic acid
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Synonyms:
ZINC2159923;STL533001;AKOS030503403;MCULE-1968746224;N-[(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetyl]glycyl-L-valine;(S)-3-methyl-2-(2-(2-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetamido)acetamido)butanoic acid;956194-25-5
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CAS No:
(2S)-3-methyl-2-[[2-[[2-(2,5,9-trimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]butanoic 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:8
Exact Mass:518.20530130
Monoisotopic Mass:518.20530130
Topological Polar Surface Area:135
Heavy Atom Count:38
Complexity:970
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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