IsoMeranzin
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IsoMeranzin
structure -
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CAS No:
1088-17-1
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Formula:
C15H16O4
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Chemical Name:
IsoMeranzin
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Synonyms:
IsoMeranzin;7-Methoxy-8-(3-methyl-2-oxobutyl)coumarin
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CAS No:
Description
Isomerazin is a coumarin isolated from Poncirus trifoliate Raf., and shows cholinesterase inhibition[1][2].
Characteristics
56.51000
1.88
1.178±0.06 g/cm3(Predicted)
66 °C
423.4±45.0 °C(Predicted)
188.9±28.8 °C
1.545
Computed Properties
Molecular Weight:260.28
XLogP3:2.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:260.10485899
Monoisotopic Mass:260.10485899
Topological Polar Surface Area:52.6
Heavy Atom Count:19
Complexity:386
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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