 Home > Encyclopedia > 2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one

2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one

2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one structure

CAS No:
3761-64-6
Formula:
C22H26O8
Chemical Name:
2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one
Synonyms:
Flavaspidic acid AB;UNII-91GX3RYD91;91GX3RYD91;SCHEMBL16352047;CHEBI:65897;ZINC100067988;MCULE-3913525512;2,5-Cyclohexadien-1-one, 2-acetyl-3,5-dihydroxy-4,4-dimethyl-6-((2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl)methyl)-;Butyrophenone, 3"-((5-acetyl-2,4-dihydroxy-3,3-dimethyl-6-oxo-1,4-cyclohexadien-1-yl)methyl)-2",4",6"-trihydroxy-5"-methyl-;Q27134389

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Description

Flavaspidic acid AB is a polyphenol that is a phloroglucinol derivative isolated from the rhizomes of Dryopteris crassirhizoma and has been shown to exhibit radical scavenging and antibacterial activity. It has a role as a metabolite and an antibacterial agent. It is a beta-hydroxy ketone, a methyl ketone, a polyphenol and an aromatic ketone. It derives from a phloroglucinol.

2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one Basic Attributes

Molecular Weight：

418.442

Exact Mass：

418.163

UNII：

91GX3RYD91

Characteristics

PSA：

152

XLogP3：

Computed Properties

Molecular Weight:418.4
XLogP3:3
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:418.16276778
Monoisotopic Mass:418.16276778
Topological Polar Surface Area:152
Heavy Atom Count:30
Complexity:806
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one

Description
Basic Attributes
Characteristics
Computed Properties

2-Acetyl-3,5-dihydroxy-4,4-dimethyl-6-[[2,4,6-trihydroxy-3-methyl-5-(1-oxobutyl)phenyl]methyl]-2,5-cyclohexadien-1-one

SDS

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