flavin adenine dinucleotide Report issue

Small molecule Experimental
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Chemistry

Mol. Mass

785.5497

ALogP

Missing data

Rule of 5

Missing data

Rule of 3

Missing data
Details
  • SMILES: CC1=CC2=C(C=C1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(O)(=O)OP(O)(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)N4C=NC5=C4N=CN=C5N)C6=NC(=O)NC(=O)C6=N2
  • InChIKey: VWWQXMAJTJZDQX-UYBVJOGSSA-N
    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
  • Chirality: None
  • Inorganic: Missing data
  • Polymer: Missing data

Sources

ZC44YTI8KK   NCATS
flavin adenine dinucleotide *

Flavin adenine dinucleotide   Wikipedia

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