2-[[(2R,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxycarbonyl]benzoic acid
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![2-[[(2R,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxycarbonyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e9377f2c2efc42d082f0b52ba0ed0f2e.png "2-[[(2R,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxycarbonyl]benzoic acid")
2-[[(2R,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxycarbonyl]benzoic acid
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CAS No:
71634-88-3
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Formula:
C23H18O9
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Chemical Name:
2-[[(2R,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxycarbonyl]benzoic acid
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Synonyms:
1,2-Benzenedicarboxylic acid, mono(2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl) ester, (2R-trans)-;71634-88-3;DTXSID70221881
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CAS No:
2-[[(2R,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxycarbonyl]benzoic acid Basic Attributes
438.4 g/mol
438.09508215 g/mol
DTXSID70221881
Computed Properties
Molecular Weight:438.4
XLogP3:2.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:438.09508215
Monoisotopic Mass:438.09508215
Topological Polar Surface Area:154
Heavy Atom Count:32
Complexity:684
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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