(+)-Dihydromethysticin
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(+)-Dihydromethysticin
structure -
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CAS No:
19902-91-1
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Formula:
C15H16O5
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Chemical Name:
(+)-Dihydromethysticin
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Synonyms:
2H-Pyran-2-one,6-[2-(1,3-benzodioxol-5-yl)ethyl]-5,6-dihydro-4-methoxy-,(6S)-;2H-Pyran-2-one,5,6-dihydro-4-methoxy-6-[3,4-(methylenedioxy)phenethyl]-,(S)-;2H-Pyran-2-one,6-[2-(1,3-benzodioxol-5-yl)ethyl]-5,6-dihydro-4-methoxy-,(S)-;Methysticin,dihydro-;(6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-5,6-dihydro-4-methoxy-2H-pyran-2-one;Methysticin,7,8-dihydro-;Dihydromethysticin;7,8-Dihydromethysticin;DHM;(+)-Dihydromethysticin;NSC 112159;(S)-(+)-Dihydromethysticin;(2S)-2-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-methoxy-2,3-dihydropyran-6-one;583-18-6
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CAS No:
Description
Dihydromethysticin is one of the six major kavalactones found in the kava plant; has marked activity on the induction of CYP3A23.
Dihydromethysticin is a member of 2-pyranones and an aromatic ether.
Characteristics
54
1.81
1.28±0.1 g/cm3(Predicted)
117-118 °C
476.1±45.0 °C(Predicted)
214.1±28.8 °C
1.576
2-8°C
Computed Properties
Molecular Weight:276.28
XLogP3:2.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:276.09977361
Monoisotopic Mass:276.09977361
Topological Polar Surface Area:54
Heavy Atom Count:20
Complexity:392
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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