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2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate;5-phenyl-3-(2-piperidin-1-ium-1-ylethyl)-1,2-oxazole
2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate;5-phenyl-3-(2-piperidin-1-ium-1-ylethyl)-1,2-oxazole
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2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate;5-phenyl-3-(2-piperidin-1-ium-1-ylethyl)-1,2-oxazole
structure -
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CAS No:
985-84-2
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Formula:
C22H28N2O8
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Chemical Name:
2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate;5-phenyl-3-(2-piperidin-1-ium-1-ylethyl)-1,2-oxazole
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Synonyms:
ISOXAZOLE, 5-PHENYL-3-(2-PIPERIDINOETHYL)-, CITRATE;985-84-2;3-(2-Piperidinoethyl)-5-phenylisoxazole citrate;DTXSID60243592
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CAS No:
2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate;5-phenyl-3-(2-piperidin-1-ium-1-ylethyl)-1,2-oxazole Basic Attributes
448.5 g/mol
448.18456586 g/mol
DTXSID60243592
Computed Properties
Molecular Weight:448.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:448.18456586
Monoisotopic Mass:448.18456586
Topological Polar Surface Area:165
Heavy Atom Count:32
Complexity:481
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
Guide of 2-(carboxymethyl)-2,4-dihydroxy-4-oxobutanoate;5-phenyl-3-(2-piperidin-1-ium-1-ylethyl)-1,2-oxazole
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