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Substance Name: Flavin-Adenine Dinucleotide
RN: 146-14-5
UNII: ZC44YTI8KK
InChIKey: VWWQXMAJTJZDQX-UYBVJOGSSA-N

Note

  • 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

  • C27-H33-N9-O15-P2

Molecular Weight

  • 785.5537
 

Classification Codes

  • Antiviral (COVID-19)
  • Drug / Therapeutic Agent
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Names and Synonyms

Results Name

  • Flavin-adenine dinucleotide

Name of Substance

  • Flavin adenin dinucleotide [JAN]
  • Flavin-adenine dinucleotide
  • Flavine-adenine dinucleotide

MeSH Heading

  • Flavin-adenine dinucleotide

Synonyms

  • 1H-Purin-6-amine, flavin dinucleotide
  • 1H-Purin-6-amine, flavine dinucleotide
  • 4-26-00-03632 (Beilstein Handbook Reference)
  • Adenine-flavin dinucleotide
  • Adenine-flavine dinucleotide
  • Adenine-riboflavin dinuceotide
  • Adenine-riboflavin dinucleotide
  • Adenine-riboflavine dinucleotide
  • BRN 0078150
  • EINECS 205-663-1
  • FAD
  • Flamitajin B
  • Flanin F
  • Flavin adenin dinucleotide
  • Flavin adenine dinucleotide
  • Flavinat
  • Flavine adenosine diphosphate
  • Flavine-adenine dinucleotide
  • Flavitan
  • Flaziren (free acid)
  • Isoalloxazine-adenine dinucleotide
  • NSC 112207
  • Riboflavin 5'-adenosine diphosphate
  • Riboflavin-adenine dinucleotide
  • Riboflavine-adenine dinucleotide
  • UNII-ZC44YTI8KK

Systematic Names

  • Adenosine 5'-(trihydrogen pyrophosphate), 5'-5'-ester with riboflavine
  • Flavin-adenine dinucleotide
  • Riboflavin 5'-(trihydrogen diphosphate), 5'-5'-ester with adenosine
  • Riboflavin 5'-(trihydrogen diphosphate), P'-5'-ester with adenosine
  • Riboflavin 5'-(trihydrogen diphosphate), P'->5'-ester with adenosine
  • Riboflavin 5'-(trihydrogen diphosphate), P'.fwdarw.5'-ester with adenosine

Registry Numbers

CAS Registry Number

  • 146-14-5

FDA UNII

  • ZC44YTI8KK

Other Registry Numbers

  • 16426-55-4
  • 887565-61-9

System Generated Number

  • 0000146145

Structure Descriptors

InChI

InChI=1S/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

InChIKey

VWWQXMAJTJZDQX-UYBVJOGSSA-N

Smiles

Cc1cc2N=C3C(=O)NC(=O)N=C3N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]4O[C@H]([C@H](O)[C@@H]4O)n5cnc6c(N)ncnc56)c2cc1C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 589mg/kg (589mg/kg)   Drugs in Japan Vol. -, Pg. 1124, 1995.
mouse LD50 oral > 7gm/kg (7000mg/kg)   Drugs in Japan Vol. -, Pg. 1124, 1995.