Identification Common Name Flavin adenine dinucleotide disodium Class Small Molecule Description Not Available Contaminant Sources ToxCast & Tox21 Chemicals Contaminant Type Not Available Chemical Structure Synonyms Value Source FAD sodium Kegg FAD Kegg Disodium 10-[(2S,3S,4R)-5-[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl phosphonato)oxy]-2,3,4-trihydroxypentyl]-7,8-dimethyl-2-oxo-2H,10H-benzo[g]pteridin-4-olic acid Generator Disodium;[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4S)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] phosphoric acid Generator Dinucleotide, flavin-adenine MeSH Flavin adenine dinucleotide MeSH Flavin-adenine dinucleotide MeSH Flavitan MeSH
Chemical Formula C27 H31 N9 Na2 O15 P2 Average Molecular Mass 829.520 g/mol Monoisotopic Mass 829.121 g/mol CAS Registry Number 84366-81-4 IUPAC Name Not Available Traditional Name disodium 10-[(2S,3S,4R)-5-({[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl phosphonato}oxy)-2,3,4-trihydroxypentyl]-7,8-dimethyl-2-oxobenzo[g]pteridin-4-olate SMILES [Na+].[Na+].[H][C@@](O)(COP([O-])(=O)OP(O)(=O)OC[C@@]1([H])O[C@@]([H])(N2C=NC3=C(N)N=CN=C23)[C@]([H])(O)[C@]1([H])O)[C@@]([H])(O)[C@@]([H])(O)CN1C2=C(C=C(C)C(C)=C2)N=C2C([O-])=NC(=O)N=C12 InChI Identifier InChI=1S/C27H33N9O15P2.2Na/c1-10-3-12-13(4-11(10)2)35(24-18(32-12)25(42)34-27(43)33-24)5-14(37)19(39)15(38)6-48-52(44,45)51-53(46,47)49-7-16-20(40)21(41)26(50-16)36-9-31-17-22(28)29-8-30-23(17)36;;/h3-4,8-9,14-16,19-21,26,37-41H,5-7H2,1-2H3,(H,44,45)(H,46,47)(H2,28,29,30)(H,34,42,43);;/q;2*+1/p-2/t14-,15+,16+,19-,20+,21+,26+;;/m0../s1 InChI Key XLRHXNIVIZZOON-WFUPGROFSA-L 
