Ligucyperonol
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Ligucyperonol
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CAS No:
105108-20-1
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Formula:
C15H22O2
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Chemical Name:
Ligucyperonol
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Synonyms:
2(3H)-Naphthalenone,4,4a,5,6,7,8-hexahydro-4-hydroxy-1,4a-dimethyl-7-(1-methylethenyl)-,(4R,4aR,7R)-;2(3H)-Naphthalenone,4,4a,5,6,7,8-hexahydro-4-hydroxy-1,4a-dimethyl-7-(1-methylethenyl)-,[4R-(4α,4aα,7α)]-;(4R,4aR,7R)-4,4a,5,6,7,8-Hexahydro-4-hydroxy-1,4a-dimethyl-7-(1-methylethenyl)-2(3H)-naphthalenone;Ligucyperonol;1β-Hydroxy-α-cyperone
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CAS No:
Characteristics
1.05±0.1 g/cm3(Predicted)
123.5-124.5 °C @ Solvent: Diisopropyl ether, Hexane
367.8±42.0 °C(Predicted)
Computed Properties
Molecular Weight:234.33
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:234.161979940
Monoisotopic Mass:234.161979940
Topological Polar Surface Area:37.3
Heavy Atom Count:17
Complexity:405
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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