(2R)-3-benzylsulfanyl-2-[[2-[(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-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/65ce29fbc9d548bf8c95f5ec1b047b08.png "(2R)-3-benzylsulfanyl-2-[[2-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[[2-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid
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CAS No:
956691-65-9
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Formula:
C25H25NO6S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[[2-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid
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Synonyms:
ZINC2120366;STL533902;AKOS030503114;MCULE-2222184668;S-benzyl-N-{[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]acetyl}-L-cysteine;(R)-3-(benzylthio)-2-(2-((6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy)acetamido)propanoic acid;956691-65-9
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CAS No:
(2R)-3-benzylsulfanyl-2-[[2-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetyl]amino]propanoic acid Basic Attributes
467.5 g/mol
467.14025869 g/mol
Computed Properties
Molecular Weight:467.5
XLogP3:3.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:467.14025869
Monoisotopic Mass:467.14025869
Topological Polar Surface Area:127
Heavy Atom Count:33
Complexity:762
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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