FLAVIN-ADENINE DINUCLEOTIDE

Flavin-Adenine Dinucleotide A condensation product of riboflavin and adenosine diphosphate. The coenzyme of various aerobic dehydrogenases, e.g., D-amino acid oxidase and L-amino acid oxidase. (Lehninger, Principles of Biochemistry, 1982, p972)

Molecular Formula: C₂₇H₃₃N₉O₁₅P₂

InChI: InChI=1/C27H33N9O15P2/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)/t14-,15+,16+,19-,20+,21+,26+/m0/s1/f/h34,44,46H,28H2

InChIKey: InChIKey=VWWQXMAJTJZDQX-DMZWQGJRDQ
SMILES: [H][C@@](O)(COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(N)ncnc23)[C@@]([H])(O)[C@@]([H])(O)CN4c5cc(C)c(C)cc5N=C6C(=O)NC(=O)N=C46

CAS number 146-14-5

Names:
    ADENOSINE 5'-(TRIHYDROGEN PYROPHOSPHATE), 5'-5'-ESTER with RIBOFLAVINE
    adenosine 5'-[3-(riboflavin-5'-yl) dihydrogen diphosphate]
    adenosine 5'-{3-[D-ribo-5-(7,8-dimethyl-2,4-dioxo-2,3,4,10-tetrahydrobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen diphosphate
    Adenosine 5'-(trihydrogen pyrophosphate), 5'-5'-ester with riboflavine
    adenosine 5'-[3-(riboflavin-5'-yl) dihydrogen diphosphate]
    CHEBI:16238
    FAD
    flavin adenine dinucleotide
    Flavin adenine dinucleotide
    Flavin-adenine dinucleotide
    FLAVIN-ADENINE DINUCLEOTIDE
    Riboflavin 5'-adenosine diphosphate
    Riboflavin 5'-(trihydrogen diphosphate), 5'-5'-ester with adenosine
    Riboflavin 5'-adenosine diphosphate
    Riboflavin 5'-(trihydrogen diphosphate), 5'-5'-ester with adenosine
    146-14-5

Registries:
    PubChem CID 643975
    Beilstein =1208946
    CAS 146-14-5 (from NIST)
    ChEBI 16238
    chemPDB FAD
    COMe MOL000039
    Gmelin 108834
    Kegg C00016
    PubChem ID 3318
    PubChem ID 8143468