α-Viniferin
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α-Viniferin
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CAS No:
62218-13-7
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Formula:
C42H30O9
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Chemical Name:
α-Viniferin
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Synonyms:
Cyclonona[1,2,3-cd:4,5,6-c'd′:7,8,9-c′′d′′]trisbenzofuran-4,9,14-triol,2,2a,7,7a,12,12a-hexahydro-2,7,12-tris(4-hydroxyphenyl)-,(2R,2aR,7R,7aR,12S,12aS)-rel-(+)-;Cyclonona[1,2,3-cd:4,5,6-c'd′:7,8,9-c′′d′′]trisbenzofuran-4,9,14-triol,2,2a,7,7a,12,12a-hexahydro-2,7,12-tris(4-hydroxyphenyl)-,(2R*,2aR*,7R*,7aR*,12S*,12aS*)-(+)-;rel-(+)-(2R,2aR,7R,7aR,12S,12aS)-2,2a,7,7a,12,12a-Hexahydro-2,7,12-tris(4-hydroxyphenyl)cyclonona[1,2,3-cd:4,5,6-c'd′:7,8,9-c′′d′′]trisbenzofuran-4,9,14-triol;α-Viniferin;(+)-α-Viniferin
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CAS No:
Description
ChEBI: A nine-membered macrocycle that incorporates three 6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuranyl moieties as part of the cyclic skeleton. It is isolated from Caragana chamlague Lamarck and exhibits significant inhibitory effect towa ds the enzyme acetylcholinesterase (EC 3.1.1.7).
(+)-alpha-viniferin is a nine-membered macrocycle that incorporates three 6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuranyl moieties as part of the cyclic skeleton. It is isolated from Caragana chamlague Lamarck and exhibits significant inhibitory effect towards the enzyme acetylcholinesterase (EC 3.1.1.7). It has a role as an anti-inflammatory agent, an EC 3.1.1.7 (acetylcholinesterase) inhibitor and a plant metabolite. It is a polyphenol, a macrocycle and a member of 1-benzofurans. It derives from a resveratrol.
Computed Properties
Molecular Weight:678.7
XLogP3:6.8
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:3
Exact Mass:678.18898253
Monoisotopic Mass:678.18898253
Topological Polar Surface Area:149
Heavy Atom Count:51
Complexity:1080
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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