Main compound image
olanzapine_10-n-glucuronide metabolite
  • Other Name: (2S,3S,4S,5R)-3,4,5-trihydroxy-6-[2-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzodiazepin-10-yl]oxyoxane-2-carboxylic acid
  • InChIKey: YFKYIRHIYFAJLP-MSLBUUDASA-N
  • InChI: InChI=1S/C23H28N4O7S/c1-12-11-13-20(26-9-7-25(2)8-10-26)24-14-5-3-4-6-15(14)27(21(13)35-12)34-23-18(30)16(28)17(29)19(33-23)22(31)32/h3-6,11,16-19,23,28-30H,7-10H2,1-2H3,(H,31,32)/t16-,17-,18+,19-,23?/m0/s1
  • SMILES: CC1=CC2=C(S1)N(C3=CC=CC=C3N=C2N4CCN(CC4)C)OC5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O
  • Exact Mass: 504.16787
  • Molecular Formula: C23H28N4O7S
  • Compound CID: pubchemlite118753566 pubchem118753566
Hidden Reactions Filter Some biological reactions link very small precursors (e.g. CO₂, acetate) to much larger products. These reactions are correct, but they can create unrealistic shortest paths and connect otherwise separate parts of the graph. To keep the overview readable, FAIR-TPs hides six such reactions where a <60 Da precursor leads to a >300 Da product in the visualisations.

You can have all these paths in the download output.
Hidden reaction pairs (precursor → product):
  • Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamidoacetamide
  • Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamido-n-methylacetamide
  • Carbon dioxide → Formylmethanofuran
  • Acrolein → Chembl3706542
  • Ethylene oxide → Acetyl-coa
  • Formaldehyde → S-hydroxymethylglutathione
Note: In the graph output, up to 100 compounds are displayed for faster visualization. For the full output, please use the export files.

Click on a node or edge to see details here.

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