(2S)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]-3-phenylpropanoic acid
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![(2S)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]-3-phenylpropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6b29c15a41ca4e0eb13816f292d5e672.png "(2S)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]-3-phenylpropanoic acid")
(2S)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]-3-phenylpropanoic acid
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CAS No:
956045-47-9
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Formula:
C29H29NO6
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Chemical Name:
(2S)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]-3-phenylpropanoic acid
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Synonyms:
ZINC2096866;EiM07-29169;AKOS030498247;MCULE-3275221495;956045-47-9
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CAS No:
(2S)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]-3-phenylpropanoic acid Basic Attributes
487.5 g/mol
487.19948764 g/mol
Computed Properties
Molecular Weight:487.5
XLogP3:4.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:487.19948764
Monoisotopic Mass:487.19948764
Topological Polar Surface Area:106
Heavy Atom Count:36
Complexity:892
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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