1-(2-benzoylpyrrol-1-yl)propan-2-yl-dimethylazanium;2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate
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1-(2-benzoylpyrrol-1-yl)propan-2-yl-dimethylazanium;2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate
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CAS No:
7001-97-0
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Formula:
C22H28N2O8
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Chemical Name:
1-(2-benzoylpyrrol-1-yl)propan-2-yl-dimethylazanium;2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate
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Synonyms:
2-Benzoyl-1-(3-(dimethylamino)propyl)pyrrole citrate;KETONE, 1-(2-(DIMETHYLAMINO)PROPYL)PYRROL-2-YL PHENYL, CITRATE
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CAS No:
1-(2-benzoylpyrrol-1-yl)propan-2-yl-dimethylazanium;2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate Basic Attributes
448.5 g/mol
448.18456586 g/mol
Computed Properties
Molecular Weight:448.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:448.18456586
Monoisotopic Mass:448.18456586
Topological Polar Surface Area:161
Heavy Atom Count:32
Complexity:519
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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