(E)-3-(β-D-Glucopyranosyl)oxy-2',4,4'-trihydroxychalcone
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(E)-3-(β-D-Glucopyranosyl)oxy-2',4,4'-trihydroxychalcone
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CAS No:
30382-19-5
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Formula:
C21H22O10
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Chemical Name:
(E)-3-(β-D-Glucopyranosyl)oxy-2',4,4'-trihydroxychalcone
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Synonyms:
Monospermoside;LMPK12120026;(E)-1-(2,4-dihydroxyphenyl)-3-[4-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one
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CAS No:
(E)-3-(β-D-Glucopyranosyl)oxy-2',4,4'-trihydroxychalcone Use and Manufacturing
Polyketides [PK] -> Flavonoids [PK12] -> Chalcones and dihydrochalcones [PK1212]
Computed Properties
Molecular Weight:434.4
XLogP3:1
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:434.12129689
Monoisotopic Mass:434.12129689
Topological Polar Surface Area:177
Heavy Atom Count:31
Complexity:627
Defined Atom Stereocenter Count:5
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
(E)-3-(β-D-Glucopyranosyl)oxy-2',4,4'-trihydroxychalcone
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