4-[4-[(α-D-Glucopyranosyl)oxy]phenyl]-9-hydroxy-8-(1,2-dihydroxyethyl)-1,7-dioxaspiro[4.4]nonane-2,6-dione
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![4-[4-[(α-D-Glucopyranosyl)oxy]phenyl]-9-hydroxy-8-(1,2-dihydroxyethyl)-1,7-dioxaspiro[4.4]nonane-2,6-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2b269e107b8c41939600e971039bc50e.png "4-[4-[(α-D-Glucopyranosyl)oxy]phenyl]-9-hydroxy-8-(1,2-dihydroxyethyl)-1,7-dioxaspiro[4.4]nonane-2,6-dione")
4-[4-[(α-D-Glucopyranosyl)oxy]phenyl]-9-hydroxy-8-(1,2-dihydroxyethyl)-1,7-dioxaspiro[4.4]nonane-2,6-dione
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CAS No:
13190-88-0
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Formula:
C21H26O13
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Chemical Name:
4-[4-[(α-D-Glucopyranosyl)oxy]phenyl]-9-hydroxy-8-(1,2-dihydroxyethyl)-1,7-dioxaspiro[4.4]nonane-2,6-dione
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Synonyms:
Leucoglycodrin;8-(1,2-dihydroxyethyl)-9-hydroxy-4-(4-(((3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-1,7-dioxaspiro[4.4]nonane-2,6-dione;Leucoglycodrin [MI];UNII-0DPO7W95LS component PEIVIQZKNGNVAD-SFIQAGIZSA-N;1,7-Dioxaspiro(4.4)nonane-2,6-dione, 8-(1,2-dihydroxyethyl)-4-(4-(D-glucopyranosyloxy)phenyl)-9-hydroxy-;Glutaric acid, 3-(p-(D-glucopyranosyloxy)phenyl)-2-hydroxy-2-(1,2,3,4-tetrahydroxybutyl)-, di-gamma-lactone
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CAS No:
4-[4-[(α-D-Glucopyranosyl)oxy]phenyl]-9-hydroxy-8-(1,2-dihydroxyethyl)-1,7-dioxaspiro[4.4]nonane-2,6-dione Basic Attributes
486.4
486.137341
0DPO7W95LS
Computed Properties
Molecular Weight:486.4
XLogP3:-2.3
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:6
Exact Mass:486.13734088
Monoisotopic Mass:486.13734088
Topological Polar Surface Area:213
Heavy Atom Count:34
Complexity:755
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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