α-Antiarin
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α-Antiarin
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CAS No:
23605-05-2
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Formula:
C29H42O11
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Chemical Name:
α-Antiarin
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Synonyms:
Card-20(22)-enolide,3-[(6-deoxy-β-D-gulopyranosyl)oxy]-5,12,14-trihydroxy-19-oxo-,(3β,5β,12β)-;α-Antiarin;(3β,5β,12β)-3-[(6-Deoxy-β-D-gulopyranosyl)oxy]-5,12,14-trihydroxy-19-oxocard-20(22)-enolide;1366-98-9;53682-14-7;744951-76-6;908578-40-5;904824-14-2
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CAS No:
Characteristics
183
-1.8
1.1849 (rough estimate)
242-242.5 °C
551.36°C (rough estimate)
Intravenous-cat LD50: 0.09 mg/kg; Intravenous-rabbit LDL0: 1 mg/kg
Flammable; burning produces irritating fumes
D17 -3.9° (c = 0.905 in methanol)
Safety Information
Treasury is ventilated, low temperature and dry; stored separately from food materials
Computed Properties
Molecular Weight:566.6
XLogP3:-1.8
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:4
Exact Mass:566.27271215
Monoisotopic Mass:566.27271215
Topological Polar Surface Area:183
Heavy Atom Count:40
Complexity:1080
Defined Atom Stereocenter Count:14
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes