(2S,3R)-3-methyl-2-[[2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetyl]amino]pentanoic acid
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![(2S,3R)-3-methyl-2-[[2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetyl]amino]pentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a0cb0cb0ec5b485f8408b92f7436a6d6.png "(2S,3R)-3-methyl-2-[[2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetyl]amino]pentanoic acid")
(2S,3R)-3-methyl-2-[[2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetyl]amino]pentanoic acid
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CAS No:
956043-68-8
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Formula:
C25H30N2O7
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Chemical Name:
(2S,3R)-3-methyl-2-[[2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetyl]amino]pentanoic acid
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Synonyms:
ZINC2120011;AKOS030503028;MCULE-3878823215;(2S,3R)-3-methyl-2-(2-(3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)acetamido)pentanoic acid;956043-68-8
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CAS No:
(2S,3R)-3-methyl-2-[[2-[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]acetyl]amino]pentanoic acid Basic Attributes
470.5 g/mol
470.20530130 g/mol
Computed Properties
Molecular Weight:470.5
XLogP3:3.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:470.20530130
Monoisotopic Mass:470.20530130
Topological Polar Surface Area:135
Heavy Atom Count:34
Complexity:854
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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