Scopolin
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Scopolin
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CAS No:
531-44-2
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Formula:
C16H18O9
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Chemical Name:
Scopolin
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Synonyms:
2H-1-Benzopyran-2-one,7-(β-D-glucopyranosyloxy)-6-methoxy-;Scopolin;7-(β-D-Glucopyranosyloxy)-6-methoxy-2H-1-benzopyran-2-one;Scopoletin 7-glucoside;6-Methoxy-7-(β-D-glucopyranosyloxy)coumarin;Scopoloside;Scopoline;Scopoletin 7-O-β-D-glucopyranoside;Scopoletin 7-O-glucoside;NSC 404560;7-O-β-Glucopyranosylscopoletin;7-(β-D-Glucopyranosyloxy)-6-methoxycoumarin;6-Methoxycoumarin 7-O-β-D-glucoside;27013-26-9
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CAS No:
Description
Scopolin is a coumarin isolated from Arabidopsis thaliana (Arabidopsis) roots[1]. Scopolin attenuated hepatic steatosis through activation of SIRT1-mediated signaling cascades[2].
Scopolin is a member of the class of coumarins that is scopoletin attached to a beta-D-glucopyranosyl residue at position 7 via a glycosidic linkage. It has a role as a plant metabolite. It is a monosaccharide derivative, a member of coumarins and a beta-D-glucoside. It derives from a scopoletin.
Computed Properties
Molecular Weight:354.31
XLogP3:-1.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:354.09508215
Monoisotopic Mass:354.09508215
Topological Polar Surface Area:135
Heavy Atom Count:25
Complexity:510
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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