2-butanoyl-4-[[3-butanoyl-5-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl]methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one
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![2-butanoyl-4-[[3-butanoyl-5-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl]methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/892ed5b2b5244cfcad41886007541950.png "2-butanoyl-4-[[3-butanoyl-5-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl]methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one")
2-butanoyl-4-[[3-butanoyl-5-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl]methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one
structure -
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CAS No:
36253-23-3
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Formula:
C35H42O12
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Chemical Name:
2-butanoyl-4-[[3-butanoyl-5-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl]methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one
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Synonyms:
Trisflavaspidic acid;36253-23-3;DTXSID40957640;2,5-Cyclohexadien-1-one, 3,5-dihydroxy-4,4- dimethyl-2-(1-oxobutyl)-6-((2,4,6-trihydroxy-3-(1-oxobutyl)-5-((2,4,6- trihydroxy-3-methyl-5-(1-oxobutyl)phenyl)methyl)phenyl)methyl)-;2-Butanoyl-4-({3-butanoyl-5-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl}methyl)-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one
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CAS No:
2-butanoyl-4-[[3-butanoyl-5-[(3-butanoyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-2,4,6-trihydroxyphenyl]methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one Basic Attributes
654.7 g/mol
654.26762677 g/mol
Computed Properties
Molecular Weight:654.7
XLogP3:5.7
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:13
Exact Mass:654.26762677
Monoisotopic Mass:654.26762677
Topological Polar Surface Area:230
Heavy Atom Count:47
Complexity:1270
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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