5,7,7′-Trihydroxy-2′-methyl-2′-(4-methyl-3-penten-1-yl)[2,6′-bi-2H-1-benzopyran]-4(3H)-one
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![5,7,7′-Trihydroxy-2′-methyl-2′-(4-methyl-3-penten-1-yl)[2,6′-bi-2H-1-benzopyran]-4(3H)-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f92e730fe063465180281ce615651d6e.png "5,7,7′-Trihydroxy-2′-methyl-2′-(4-methyl-3-penten-1-yl)[2,6′-bi-2H-1-benzopyran]-4(3H)-one")
5,7,7′-Trihydroxy-2′-methyl-2′-(4-methyl-3-penten-1-yl)[2,6′-bi-2H-1-benzopyran]-4(3H)-one
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CAS No:
71344-07-5
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Formula:
C25H26O6
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Chemical Name:
5,7,7′-Trihydroxy-2′-methyl-2′-(4-methyl-3-penten-1-yl)[2,6′-bi-2H-1-benzopyran]-4(3H)-one
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Synonyms:
[2,6′-Bi-2H-1-benzopyran]-4(3H)-one,5,7,7′-trihydroxy-2′-methyl-2′-(4-methyl-3-penten-1-yl)-;[2,6′-Bi-2H-1-benzopyran]-4(3H)-one,5,7,7′-trihydroxy-2′-methyl-2′-(4-methyl-3-pentenyl)-;5,7,7′-Trihydroxy-2′-methyl-2′-(4-methyl-3-penten-1-yl)[2,6′-bi-2H-1-benzopyran]-4(3H)-one;Kuwanon F
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CAS No:
5,7,7′-Trihydroxy-2′-methyl-2′-(4-methyl-3-penten-1-yl)[2,6′-bi-2H-1-benzopyran]-4(3H)-one Basic Attributes
422.5 g/mol
422.47
5,7,7′-Trihydroxy-2′-methyl-2′-(4-methyl-3-penten-1-yl)[2,6′-bi-2H-1-benzopyran]-4(3H)-one Use and Manufacturing
Polyketides [PK] -> Flavonoids [PK12] -> Flavanones [PK1214]
Computed Properties
Molecular Weight:422.5
XLogP3:5.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:422.17293854
Monoisotopic Mass:422.17293854
Topological Polar Surface Area:96.2
Heavy Atom Count:31
Complexity:728
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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