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Substance Name: 6-Azido-fad
RN: 101760-85-4
InChIKey: RQLZKEINAGKZBZ-UHFFFAOYSA-N

Note

  • A photoreactive FAD analog.

Molecular Formula

  • C27-H32-N12-O15-P2

Molecular Weight

  • 826.567
 
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Names and Synonyms

Name of Substance

  • 6-Azido-fad

Systematic Name

  • Riboflavin 5'-(trihydrogen diphosphate), 6-azido-, 5'-5'-ester with adenosine

Registry Numbers

CAS Registry Number

  • 101760-85-4

System Generated Number

  • 0101760854

Structure Descriptors

InChI

1S/C27H32N12O15P2/c1-9-3-11-16(15(10(9)2)36-37-29)33-18-24(34-27(46)35-25(18)45)38(11)4-12(40)19(42)13(41)5-51-55(47,48)54-56(49,50)52-6-14-20(43)21(44)26(53-14)39-8-32-17-22(28)30-7-31-23(17)39/h3,7-8,12-14,19-21,26,40-44H,4-6H2,1-2H3,(H,47,48)(H,49,50)(H2,28,30,31)(H,35,45,46)

InChIKey

RQLZKEINAGKZBZ-UHFFFAOYSA-N

Smiles

c1n([C@@H]2[C@@H]([C@@H](O)[C@@H](O2)CO[P@@](=O)(O)O[P@@](=O)(OC[C@@H]([C@@H]([C@@H](Cn2c3cc(c(c(c3nc3c2nc([nH]c3=O)=O)N=[N+]=[N-])C)C)O)O)O)O)O)c2ncnc(c2n1)N