8-O-Acetylharpagide
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8-O-Acetylharpagide
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CAS No:
6926-14-3
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Formula:
C17H26O11
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Chemical Name:
8-O-Acetylharpagide
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Synonyms:
β-D-Glucopyranoside,(1S,4aS,5R,7S,7aS)-7-(acetyloxy)-1,4a,5,6,7,7a-hexahydro-4a,5-dihydroxy-7-methylcyclopenta[c]pyran-1-yl;Glucopyranoside,1β,4a,5,6,7,7aα-hexahydro-4aα,5α,7α-trihydroxy-7-methylcyclopenta[c]pyran-1-yl,7-acetate,β-D-;β-D-Glucopyranoside,7-(acetyloxy)-1,4a,5,6,7,7a-hexahydro-4a,5-dihydroxy-7-methylcyclopenta[c]pyran-1-yl,[1S-(1α,4aα,5α,7α,7aα)]-;Harpagide,8-acetate;(1S,4aS,5R,7S,7aS)-7-(Acetyloxy)-1,4a,5,6,7,7a-hexahydro-4a,5-dihydroxy-7-methylcyclopenta[c]pyran-1-yl β-D-glucopyranoside;8-O-Acetylharpagide;8-Acetylharpagide;Harpagide acetate;131862-12-9;26805-51-6;40293-11-6
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CAS No:
Description
8-O-Acetylharpagide is an iridoid isolated from Ajuga reptans with antitumoral, antiviral, antibacterial, and anti-inflammatory activities. 8-O-Acetylharpagide also has a biological activity on isolated smooth muscle preparations from guinea pig[1][2].
Computed Properties
Molecular Weight:406.4
XLogP3:-2.7
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:5
Exact Mass:406.14751164
Monoisotopic Mass:406.14751164
Topological Polar Surface Area:175
Heavy Atom Count:28
Complexity:626
Undefined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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