(2R)-2-[[2-[(3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl)oxy]acetyl]amino]-3-methylsulfanylpropanoic acid
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![(2R)-2-[[2-[(3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl)oxy]acetyl]amino]-3-methylsulfanylpropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/04246148e5864d4289dc161b6642980f.png "(2R)-2-[[2-[(3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl)oxy]acetyl]amino]-3-methylsulfanylpropanoic acid")
(2R)-2-[[2-[(3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl)oxy]acetyl]amino]-3-methylsulfanylpropanoic acid
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CAS No:
956752-36-6
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Formula:
C20H23NO6S
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Chemical Name:
(2R)-2-[[2-[(3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl)oxy]acetyl]amino]-3-methylsulfanylpropanoic acid
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Synonyms:
ZINC2121096;STL534719;AKOS030503681;MCULE-8277159722;(R)-2-(2-((3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl)oxy)acetamido)-3-(methylthio)propanoic acid;956752-36-6;S-methyl-N-{[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl)oxy]acetyl}-L-cysteine
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CAS No:
(2R)-2-[[2-[(3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl)oxy]acetyl]amino]-3-methylsulfanylpropanoic acid Basic Attributes
405.5 g/mol
405.12460863 g/mol
Computed Properties
Molecular Weight:405.5
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:405.12460863
Monoisotopic Mass:405.12460863
Topological Polar Surface Area:127
Heavy Atom Count:28
Complexity:663
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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