Harpagoside
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Harpagoside
structure -
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CAS No:
19210-12-9
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Formula:
C24H30O11
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Chemical Name:
Harpagoside
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Synonyms:
β-D-Glucopyranoside,(1S,4aS,5R,7S,7aS)-1,4a,5,6,7,7a-hexahydro-4a,5-dihydroxy-7-methyl-7-[[(2E)-1-oxo-3-phenyl-2-propen-1-yl]oxy]cyclopenta[c]pyran-1-yl;Harpagoside;β-D-Glucopyranoside,1,4a,5,6,7,7a-hexahydro-4a,5-dihydroxy-7-methyl-7-[(1-oxo-3-phenyl-2-propenyl)oxy]cyclopenta[c]pyran-1-yl,[1S-[1α,4aα,5α,7α(E),7aα]]-;β-D-Glucopyranoside,(1S,4aS,5R,7S,7aS)-1,4a,5,6,7,7a-hexahydro-4a,5-dihydroxy-7-methyl-7-[[(2E)-1-oxo-3-phenyl-2-propenyl]oxy]cyclopenta[c]pyran-1-yl;(1S,4aS,5R,7S,7aS)-1,4a,5,6,7,7a-Hexahydro-4a,5-dihydroxy-7-methyl-7-[[(2E)-1-oxo-3-phenyl-2-propen-1-yl]oxy]cyclopenta[c]pyran-1-yl β-D-glucopyranoside;E-Harpagoside
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CAS No:
Description
Harpagoside is isolated from Harpagophytum procumbens (Hp). Harpagoside has inhibitory effects on COX-1 and COX-2 activity and inhibits NO production[1].
Harpagoside is a terpene glycoside.
Characteristics
175
-0.6
White to off-white powder.
1.52±0.1 g/cm3(Predicted)
120°C(dec.)
720.7±60.0 °C(Predicted)
244.3±26.4 °C
1.660
2-8°C
8.49E-22mmHg at 25°C
Safety Information
3172
3
22
22-45-24/25
Xn
P301 + P312 + P330
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory.
Harpagoside Use and Manufacturing
Standard for analysis of herbal products.
Lipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]
Computed Properties
Molecular Weight:494.5
XLogP3:-0.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:494.17881177
Monoisotopic Mass:494.17881177
Topological Polar Surface Area:175
Heavy Atom Count:35
Complexity:811
Defined Atom Stereocenter Count:10
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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