(2S)-2-[[(3R,4S)-4,8-dihydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid
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![(2S)-2-[[(3R,4S)-4,8-dihydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0914cdf9140042d099aa6a89ca5b3c29.png "(2S)-2-[[(3R,4S)-4,8-dihydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid")
(2S)-2-[[(3R,4S)-4,8-dihydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid
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CAS No:
80621-16-5
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Formula:
C20H19NO7
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Chemical Name:
(2S)-2-[[(3R,4S)-4,8-dihydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid
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Synonyms:
80621-16-5;L-Phenylalanine, N-((3,4-dihydro-4,8-dihydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl)-, (3R-trans)-;DTXSID00230441
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CAS No:
(2S)-2-[[(3R,4S)-4,8-dihydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid Basic Attributes
385.4 g/mol
385.11615195 g/mol
DTXSID00230441
Computed Properties
Molecular Weight:385.4
XLogP3:3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:385.11615195
Monoisotopic Mass:385.11615195
Topological Polar Surface Area:133
Heavy Atom Count:28
Complexity:603
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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