Neoline
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Neoline
structure -
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CAS No:
466-26-2
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Formula:
C24H39NO6
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Chemical Name:
Neoline
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Synonyms:
Aconitane-1,8,14-triol,20-ethyl-6,16-dimethoxy-4-(methoxymethyl)-,(1α,6α,14α,16β)-;Neoline;Bullatine B;11aH-12,3,6a-Ethanylylidene-7,9-methanonaphth[2,3-b]azocine,aconitane-1,8,14-triol deriv.;(1α,6α,14α,16β)-20-Ethyl-6,16-dimethoxy-4-(methoxymethyl)aconitane-1,8,14-triol;Dideacetyldelphisine;Xuan-Wu 3;1354-85-4;1368-48-5;856565-15-6
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CAS No:
Description
Neoline, the active ingredient of processed aconite root (PA), alleviated oxaliplatin-induced peripheral neuropathy in mice. Neoline can be used as a marker compound to determine the quality of the PA products for the treatment of neuropathic pain[1].
Characteristics
91.6
0.43990
1.3±0.1 g/cm3
153-154 °C
578.3°C at 760 mmHg
303.5±30.1 °C
1.602
8.84E-16mmHg at 25°C
LD50 intraperitoneal in mouse: 150mg/kg
Computed Properties
Molecular Weight:437.6
XLogP3:-0.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:437.27773796
Monoisotopic Mass:437.27773796
Topological Polar Surface Area:91.6
Heavy Atom Count:31
Complexity:752
Undefined Atom Stereocenter Count:13
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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