(2S)-2-[[2-(4-ethyl-8-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(1H-indol-3-yl)propanoic acid
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![(2S)-2-[[2-(4-ethyl-8-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(1H-indol-3-yl)propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ebe509fa49a549cd8877463c6f8eacfa.png "(2S)-2-[[2-(4-ethyl-8-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(1H-indol-3-yl)propanoic acid")
(2S)-2-[[2-(4-ethyl-8-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(1H-indol-3-yl)propanoic acid
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CAS No:
956047-04-4
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Formula:
C25H24N2O6
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Chemical Name:
(2S)-2-[[2-(4-ethyl-8-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(1H-indol-3-yl)propanoic acid
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Synonyms:
N-{[(4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-L-tryptophan;ZINC2146599;EiM07-16852;STL460590;AKOS004937665;MCULE-7491298997;956047-04-4
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CAS No:
(2S)-2-[[2-(4-ethyl-8-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(1H-indol-3-yl)propanoic acid Basic Attributes
448.5 g/mol
448.16343649 g/mol
Computed Properties
Molecular Weight:448.5
XLogP3:3.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:448.16343649
Monoisotopic Mass:448.16343649
Topological Polar Surface Area:118
Heavy Atom Count:33
Complexity:783
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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