CONOCARPAN
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CONOCARPAN
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CAS No:
221666-27-9
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Formula:
C18H18O2
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Chemical Name:
CONOCARPAN
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Synonyms:
CONOCARPAN;(+)-Cocarpan;4-[(2S,3S)-2,3-Dihydro-3-methyl-5-(1E)-1-propen-1-yl-2-benzofuranyl]phenol
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CAS No:
Description
(+)-conocarpan is a member of the class of benzofurans that is 2,3-dihydro-1-benzofuran substituted by a methyl group at position 3, a prop-1-en-1-yl group at position 5 and a 4-hydroxyphenyl group at position 2. It is a lignan derivative isolated from the roots of Krameria lappacea. It has a role as an anti-inflammatory agent, a cyclooxygenase 1 inhibitor, a cyclooxygenase 2 inhibitor, a NF-kappaB inhibitor and a plant metabolite. It is a member of benzofurans and a member of phenols.
Computed Properties
Molecular Weight:266.3
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:266.130679813
Monoisotopic Mass:266.130679813
Topological Polar Surface Area:29.5
Heavy Atom Count:20
Complexity:343
Defined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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