3-O-methyl 4-O-(3,4,5-trimethoxybenzoyl) (2S,3S,4R)-2-(1,3-benzodioxol-5-yl)-2-methyl-5-oxooxolane-3,4-dicarboxylate
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3-O-methyl 4-O-(3,4,5-trimethoxybenzoyl) (2S,3S,4R)-2-(1,3-benzodioxol-5-yl)-2-methyl-5-oxooxolane-3,4-dicarboxylate
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CAS No:
122860-98-4
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Formula:
C25H24O12
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Chemical Name:
3-O-methyl 4-O-(3,4,5-trimethoxybenzoyl) (2S,3S,4R)-2-(1,3-benzodioxol-5-yl)-2-methyl-5-oxooxolane-3,4-dicarboxylate
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Synonyms:
dimethyl 2,3,4,5-tetrahydro-5-(3,4-methylenedioxyphenyl)-2-oxo-3-(3,4,5-trimethoxybenzoyl)-3,4-furandicarboxylate;TMTM-furandicarboxylic acid;122860-98-4;Tmtm-furandicarboxylic acid;DTXSID20924299;3,4-Furandicarboxylic acid, 2-(1,3-benzodioxol-5-yl)tetrahydro-5-oxo-4-(3,4,5-trimethoxybenzoyl)-, dimethyl ester, (2alpha,3beta,4beta)-;5-(2H-1,3-Benzodioxol-5-yl)-4-(methoxycarbonyl)-5-methyl-2-oxooxolane-3-carboxylic 3,4,5-trimethoxybenzoic anhydride;Dimethyl 2,3,4,5-tetrahydro-5-(3,4-methylenedioxyphenyl)-2-oxo-3-(3,4,5-trimethoxybenzoyl)-3,4-furandicarboxylate
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CAS No:
3-O-methyl 4-O-(3,4,5-trimethoxybenzoyl) (2S,3S,4R)-2-(1,3-benzodioxol-5-yl)-2-methyl-5-oxooxolane-3,4-dicarboxylate Basic Attributes
516.4 g/mol
516.12677620 g/mol
Drug Information
dimethyl 2,3,4,5-tetrahydro-5-(3,4-methylenedioxyphenyl)-2-oxo-3-(3,4,5-trimethoxybenzoyl)-3,4-furandicarboxylate
Computed Properties
Molecular Weight:516.4
XLogP3:2.7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:10
Exact Mass:516.12677620
Monoisotopic Mass:516.12677620
Topological Polar Surface Area:142
Heavy Atom Count:37
Complexity:877
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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