(2S)-3-(4-hydroxyphenyl)-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]propanoic acid
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![(2S)-3-(4-hydroxyphenyl)-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/43e1e4d9800b42a3bd534072c633ea66.png "(2S)-3-(4-hydroxyphenyl)-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]propanoic acid")
(2S)-3-(4-hydroxyphenyl)-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]propanoic acid
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CAS No:
955918-61-3
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Formula:
C27H25NO7
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Chemical Name:
(2S)-3-(4-hydroxyphenyl)-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]propanoic acid
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Synonyms:
ZINC2100623;EiM07-29242;AKOS030498884;MCULE-6138274188;955918-61-3
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CAS No:
(2S)-3-(4-hydroxyphenyl)-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]propanoic acid Basic Attributes
475.5 g/mol
475.16310214 g/mol
Computed Properties
Molecular Weight:475.5
XLogP3:3.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:475.16310214
Monoisotopic Mass:475.16310214
Topological Polar Surface Area:126
Heavy Atom Count:35
Complexity:877
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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