Araboflavin structure

Araboflavin

7,8-dimethyl-10-[(2S,3R,4S)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione

Also Known As: Araboflavin|L-Araboflavin|Riboflavin Impurity 14|10-Arabityl-7,8-dimethylisoalloxazine|1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2h)-yl)-l-arabinitol|1-(3,4-Dihydro-7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10(2H)-yl)-1-deoxy-L-arabinitol|1-Deoxy-1-(4-hydroxy-7,8-dimethyl-2-oxobenzo[g]pteridin-10(2H)-yl)-L-arabinitol|1-deoxy-1-(4-hydroxy-7,8-dimethyl-2-oxobenzo[g]pteridin-10(2H)-yl)pentitol|7,8-dimethyl-10-[(2S,3R,4S)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione|7,8-dimethyl-10-((2S,3R,4S)-2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4(3H,10H)-dione|7,8-dimethyl-10-[(2S,3R,4S)-2,3,4,5-tetrahydroxypentyl]-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione

CAS: 5443-31-2
Molecular Formula C17H20N4O6
Molecular Weight 376.13828 g/mol
LogP -1.5
Topological Polar Surface Area 155.0 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 376.13828
Monoisotopic Mass 376.13828
Heavy Atoms 27
Complexity 680.0

Chemical Identifiers

CAS Number 5443-31-2
SMILES CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@H]([C@H](CO)O)O)O
InChIKey AUNGANRZJHBGPY-SGMGOOAPSA-N

Product Overview

Araboflavin (CAS 5443-31-2), with molecular formula C17H20N4O6 and molecular weight 376.13828 g/mol. IUPAC: 7,8-dimethyl-10-[(2S,3R,4S)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione.

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