Pomiferin
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Pomiferin
structure -
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CAS No:
572-03-2
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Formula:
C25H24O6
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Chemical Name:
Pomiferin
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Synonyms:
4H,8H-Benzo[1,2-b:3,4-b′]dipyran-4-one,3-(3,4-dihydroxyphenyl)-5-hydroxy-8,8-dimethyl-6-(3-methyl-2-buten-1-yl)-;4H,8H-Benzo[1,2-b:3,4-b′]dipyran-4-one,3-(3,4-dihydroxyphenyl)-5-hydroxy-8,8-dimethyl-6-(3-methyl-2-butenyl)-;3-(3,4-Dihydroxyphenyl)-5-hydroxy-8,8-dimethyl-6-(3-methyl-2-buten-1-yl)-4H,8H-benzo[1,2-b:3,4-b′]dipyran-4-one;Pomiferin;Pomiferin (flavonoid);NSC 5113;3′-Hydroxyosajin
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CAS No:
Characteristics
96.2
5.5
1.314±0.06 g/cm3(Predicted)
>300℃
205.8 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]
Drug Information
3-(3,4-dihydroxyphenyl)-5-hydroxy-8,8-dimethyl-6-(3-methylbut-2-enyl)-4H,8H-pyrano(2,3-h)chromen-4-one
Computed Properties
Molecular Weight:420.5
XLogP3:5.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:420.15728848
Monoisotopic Mass:420.15728848
Topological Polar Surface Area:96.2
Heavy Atom Count:31
Complexity:792
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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