Gentianine
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Gentianine
structure -
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CAS No:
439-89-4
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Formula:
C10H9NO2
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Chemical Name:
Gentianine
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Synonyms:
1H-Pyrano[3,4-c]pyridin-1-one,5-ethenyl-3,4-dihydro-;1H-Pyrano[3,4-c]pyridin-1-one,3,4-dihydro-5-vinyl-;Gentianine;Nicotinic acid,4-(2-hydroxyethyl)-5-vinyl-,δ-lactone;5-Ethenyl-3,4-dihydro-1H-pyrano[3,4-c]pyridin-1-one;NSC 606848;5-Vinyl-3,4-dihydropyrano[3,4-c]pyridin-1-one
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CAS No:
Description
Gentianine, an active metabolite of Swertiamarin, has anti-diabetic effect and anti-inflammatory property[1][2].
Gentianine is a pyranopyridine, a lactone and a pyridine alkaloid.
Characteristics
39.19000
1.73
1.2±0.1 g/cm3
81-83 °C
386.5±42.0 °C at 760 mmHg
187.6±27.9 °C
1.604
3.52E-06mmHg at 25°C
Computed Properties
Molecular Weight:175.18
XLogP3:1.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:175.063328530
Monoisotopic Mass:175.063328530
Topological Polar Surface Area:39.2
Heavy Atom Count:13
Complexity:227
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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