(2S,3R)-2-[[2-[[2-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
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![(2S,3R)-2-[[2-[[2-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/25b9f788dc2349ab94b98231fc87baa8.png "(2S,3R)-2-[[2-[[2-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid")
(2S,3R)-2-[[2-[[2-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
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CAS No:
956047-95-3
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Formula:
C26H32N2O7
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Chemical Name:
(2S,3R)-2-[[2-[[2-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
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Synonyms:
ZINC2122700;STL531031;AKOS030503936;MCULE-8209457706;N-[(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]glycyl-L-isoleucine;(2S,3R)-2-(2-(2-(3-(tert-butyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamido)acetamido)-3-methylpentanoic acid;956047-95-3
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CAS No:
(2S,3R)-2-[[2-[[2-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid Basic Attributes
484.5 g/mol
484.22095136 g/mol
Computed Properties
Molecular Weight:484.5
XLogP3:3.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:484.22095136
Monoisotopic Mass:484.22095136
Topological Polar Surface Area:135
Heavy Atom Count:35
Complexity:891
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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