4-[4-(2,4-dihydroxy-3,5,6-trimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid
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![4-[4-(2,4-dihydroxy-3,5,6-trimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c156ac47527d4671bfb1e3dcf6b96190.png "4-[4-(2,4-dihydroxy-3,5,6-trimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid")
4-[4-(2,4-dihydroxy-3,5,6-trimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid
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CAS No:
86413-60-7
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Formula:
C32H36O10
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Chemical Name:
4-[4-(2,4-dihydroxy-3,5,6-trimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid
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Synonyms:
Benzoic acid,4-((2,4-dihydroxy-3,5,6-trimethylbenzoyl)oxy)-2-methoxy-3,5,6-trimethyl-,4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester; Thielavin-C;
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CAS No:
4-[4-(2,4-dihydroxy-3,5,6-trimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid Basic Attributes
580.62200
580.23084734 g/mol
DTXSID20235534
Computed Properties
Molecular Weight:580.6
XLogP3:7.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:9
Exact Mass:580.23084734
Monoisotopic Mass:580.23084734
Topological Polar Surface Area:149
Heavy Atom Count:42
Complexity:971
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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