input word = C00019353

Metabolite InformationStructural formula
Name ADP
Adenosine 5'-diphosphate
Formula C10H15N5O10P2
Mw 427.02941472
CAS RN 58-64-0
C_ID C00019353 ,
InChIKey XTWYTFMLZFPYCI-CNAPFFGINA-N
InChICode InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6+,7+,10-/m0/s1
SMILES n1([C@@H]2[C@@H]([C@@H]([C@H](CO[P@@](=O)(O)OP(=O)(O)O)O2)O)O)cnc2c1ncnc2N
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate L-Asp L-Phe L-His
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
BacteriaEnterobacteriaceaeEscherichia coli Ref.
PlantaeCannabaceaeHumulus lupulus Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaeFabaceaePhaseolus vulgaris Ref.
PlantaePoaceaeOryza sativa Ref.
--FOOD SAKE Ref.
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OrganismFOOD SAKE
ReferenceIwashita,National Research Institute of Brewing (unpublished)