2-hydroxy-5-[(2-hydroxy-5-methylphenyl)-[3-[(2-hydroxy-5-methylphenyl)-(4-hydroxy-2-methyl-5-sulfophenyl)methyl]-2-oxo-1,3-diazetidin-1-yl]methyl]-4-methylbenzenesulfonic acid
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![2-hydroxy-5-[(2-hydroxy-5-methylphenyl)-[3-[(2-hydroxy-5-methylphenyl)-(4-hydroxy-2-methyl-5-sulfophenyl)methyl]-2-oxo-1,3-diazetidin-1-yl]methyl]-4-methylbenzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/fda2fb7a96b24f40886c52a842df353b.png "2-hydroxy-5-[(2-hydroxy-5-methylphenyl)-[3-[(2-hydroxy-5-methylphenyl)-(4-hydroxy-2-methyl-5-sulfophenyl)methyl]-2-oxo-1,3-diazetidin-1-yl]methyl]-4-methylbenzenesulfonic acid")
2-hydroxy-5-[(2-hydroxy-5-methylphenyl)-[3-[(2-hydroxy-5-methylphenyl)-(4-hydroxy-2-methyl-5-sulfophenyl)methyl]-2-oxo-1,3-diazetidin-1-yl]methyl]-4-methylbenzenesulfonic acid
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CAS No:
26438-00-6
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Formula:
C32H32N2O11S2
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Chemical Name:
2-hydroxy-5-[(2-hydroxy-5-methylphenyl)-[3-[(2-hydroxy-5-methylphenyl)-(4-hydroxy-2-methyl-5-sulfophenyl)methyl]-2-oxo-1,3-diazetidin-1-yl]methyl]-4-methylbenzenesulfonic acid
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Synonyms:
26438-00-6;NSC205022;DTXSID20330139;NSC-205022;2-hydroxy-5-[(2-hydroxy-5-methylphenyl)-[3-[(2-hydroxy-5-methylphenyl)-(4-hydroxy-2-methyl-5-sulfophenyl)methyl]-2-oxo-1,3-diazetidin-1-yl]methyl]-4-methylbenzenesulfonic acid
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CAS No:
2-hydroxy-5-[(2-hydroxy-5-methylphenyl)-[3-[(2-hydroxy-5-methylphenyl)-(4-hydroxy-2-methyl-5-sulfophenyl)methyl]-2-oxo-1,3-diazetidin-1-yl]methyl]-4-methylbenzenesulfonic acid Basic Attributes
684.7 g/mol
684.14475219 g/mol
205022
DTXSID20330139
Computed Properties
Molecular Weight:684.7
XLogP3:4.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:8
Exact Mass:684.14475219
Monoisotopic Mass:684.14475219
Topological Polar Surface Area:230
Heavy Atom Count:47
Complexity:1240
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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