(2S,3R)-3-methyl-2-[[2-(2,3,5-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]pentanoic acid
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![(2S,3R)-3-methyl-2-[[2-(2,3,5-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]pentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f3a18bde2240484a95414c75f66e7001.png "(2S,3R)-3-methyl-2-[[2-(2,3,5-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]pentanoic acid")
(2S,3R)-3-methyl-2-[[2-(2,3,5-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]pentanoic acid
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CAS No:
956041-83-1
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Formula:
C22H25NO6
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Chemical Name:
(2S,3R)-3-methyl-2-[[2-(2,3,5-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]pentanoic acid
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Synonyms:
ZINC2157552;AKOS030499405;MCULE-1134359030;(2S,3R)-3-methyl-2-(2-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamido)pentanoic acid;956041-83-1
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CAS No:
(2S,3R)-3-methyl-2-[[2-(2,3,5-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]pentanoic acid Basic Attributes
399.4 g/mol
399.16818752 g/mol
Computed Properties
Molecular Weight:399.4
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:399.16818752
Monoisotopic Mass:399.16818752
Topological Polar Surface Area:106
Heavy Atom Count:29
Complexity:716
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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