(2S,3S)-3-methyl-2-[[2-[[2-[5-methyl-3-(4-methylphenyl)-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]acetyl]amino]pentanoic acid
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![(2S,3S)-3-methyl-2-[[2-[[2-[5-methyl-3-(4-methylphenyl)-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]acetyl]amino]pentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6c83606915664e1385208d2245daa016.png "(2S,3S)-3-methyl-2-[[2-[[2-[5-methyl-3-(4-methylphenyl)-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]acetyl]amino]pentanoic acid")
(2S,3S)-3-methyl-2-[[2-[[2-[5-methyl-3-(4-methylphenyl)-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]acetyl]amino]pentanoic acid
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CAS No:
956707-30-5
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Formula:
C29H30N2O7
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Chemical Name:
(2S,3S)-3-methyl-2-[[2-[[2-[5-methyl-3-(4-methylphenyl)-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]acetyl]amino]pentanoic acid
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Synonyms:
ZINC2161264;EiM07-28567;AKOS032429350;MCULE-3176305633;956707-30-5
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CAS No:
(2S,3S)-3-methyl-2-[[2-[[2-[5-methyl-3-(4-methylphenyl)-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]acetyl]amino]pentanoic acid Basic Attributes
518.6 g/mol
518.20530130 g/mol
Computed Properties
Molecular Weight:518.6
XLogP3:4.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:518.20530130
Monoisotopic Mass:518.20530130
Topological Polar Surface Area:135
Heavy Atom Count:38
Complexity:955
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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