(2R)-3-benzylsulfanyl-2-[[2-[(4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid
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![(2R)-3-benzylsulfanyl-2-[[2-[(4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ae73c636d6254834bb22a08b3d8f0f34.png "(2R)-3-benzylsulfanyl-2-[[2-[(4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[[2-[(4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid
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CAS No:
956192-89-5
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Formula:
C26H27NO6S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[[2-[(4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid
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Synonyms:
ZINC2113106;STL534675;AKOS030501741;MCULE-1898406876;(R)-3-(benzylthio)-2-(2-((4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanoic acid;956192-89-5;S-benzyl-N-{[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]acetyl}-L-cysteine
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CAS No:
(2R)-3-benzylsulfanyl-2-[[2-[(4-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid Basic Attributes
481.6 g/mol
481.15590875 g/mol
Computed Properties
Molecular Weight:481.6
XLogP3:4.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:481.15590875
Monoisotopic Mass:481.15590875
Topological Polar Surface Area:127
Heavy Atom Count:34
Complexity:792
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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