2-amino-3-[1-[[7-methyl-2,4-dioxo-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propanoic acid
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![2-amino-3-[1-[[7-methyl-2,4-dioxo-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0311c13c266a48148f70752c33724914.png "2-amino-3-[1-[[7-methyl-2,4-dioxo-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propanoic acid")
2-amino-3-[1-[[7-methyl-2,4-dioxo-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propanoic acid
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CAS No:
37854-44-7
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Formula:
C23H27N7O8
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Chemical Name:
2-amino-3-[1-[[7-methyl-2,4-dioxo-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propanoic acid
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Synonyms:
8 alpha-(N(3)-histidyl)riboflavin;N(3)-histidylriboflavin;N(3)-Histidylriboflavin;8alpha-(N(3)-Histidyl)riboflavin;Riboflavin, alpha8-(4-(2-amino-2-carboxyethyl)-1H-imidazol-1-yl)-, (S)-;37854-44-7
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CAS No:
2-amino-3-[1-[[7-methyl-2,4-dioxo-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propanoic acid Basic Attributes
529.5 g/mol
529.19211085 g/mol
Computed Properties
Molecular Weight:529.5
XLogP3:-5.4
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:10
Exact Mass:529.19211085
Monoisotopic Mass:529.19211085
Topological Polar Surface Area:236
Heavy Atom Count:38
Complexity:993
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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