input word = C00007445

Metabolite InformationStructural formula
Name Adenosine 5'-phosphosulfate
Formula C10H14N5O10PS
Mw 427.01989893
CAS RN 485-84-7
C_ID C00007445 ,
InChIKey IRLPACMLTUPBCL-CNAPFFGINA-N
InChICode InChI=1S/C10H14N5O10PS/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-26(18,19)25-27(20,21)22/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H2,11,12,13)(H,20,21,22)/t4-,6+,7+,10-/m0/s1
SMILES n1c2c(c(nc1)N)ncn2[C@@H]1[C@@H]([C@H](O)[C@@H](O1)CO[P@@](=O)(O)OS(=O)(=O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-Phe
Organism
Kingdom Family Species Reference
BacteriaEnterobacteriaceaeEscherichia coli K12 Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
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