input word = C00001500

Metabolite InformationStructural formula
Name FAD
Flavin adenine dinucleotide
Formula C27H33N9O15P2
Mw 785.15713443
CAS RN 146-14-5
C_ID C00001500 ,
InChIKey VWWQXMAJTJZDQX-WRQDJXGLNA-N
InChICode 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
SMILES n1cnc2c(c1N)ncn2[C@H]1O[C@@H]([C@@H]([C@@H]1O)O)CO[P@@](=O)(O)O[P@](=O)(O)OC[C@@H](O)[C@H]([C@H](Cn1c2c(nc3c1nc(=O)[nH]c3=O)cc(c(c2)C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate L-Ala
Organism
Kingdom Family Species Reference
BacteriaEnterobacteriaceaeEscherichia coli Ref.
--FOOD SAKE Ref.
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