(2S)-2-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-3-(1H-indol-3-yl)propanoic acid
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![(2S)-2-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-3-(1H-indol-3-yl)propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/91e2037a49d64647b79071ebbe9699b6.png "(2S)-2-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-3-(1H-indol-3-yl)propanoic acid")
(2S)-2-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-3-(1H-indol-3-yl)propanoic acid
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CAS No:
956047-96-4
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Formula:
C27H24N2O6
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Chemical Name:
(2S)-2-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-3-(1H-indol-3-yl)propanoic acid
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Synonyms:
ZINC2105418;STL529363;AKOS030499779;MCULE-8743963853;N-[3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-L-tryptophan;(S)-2-(3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)-3-(1H-indol-3-yl)propanoic acid;956047-96-4
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CAS No:
(2S)-2-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-3-(1H-indol-3-yl)propanoic acid Basic Attributes
472.5 g/mol
472.16343649 g/mol
Computed Properties
Molecular Weight:472.5
XLogP3:3.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:472.16343649
Monoisotopic Mass:472.16343649
Topological Polar Surface Area:122
Heavy Atom Count:35
Complexity:887
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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