Main compound image
olanzapine_4'-n-glucuronide metabolite
  • Other Name: (2S,3S,4S,5R)-3,4,5-trihydroxy-6-[1-methyl-4-(2-methyl-10H-thieno[2,3-b][1,5]benzodiazepin-4-yl)piperazin-1-ium-1-yl]oxyoxane-2-carboxylic acid
  • InChIKey: AVDLUALFBAOEQY-MSLBUUDASA-O
  • InChI: InChI=1S/C23H28N4O7S/c1-12-11-13-20(24-14-5-3-4-6-15(14)25-21(13)35-12)26-7-9-27(2,10-8-26)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-,24,25,31,32)/p+1/t16-,17-,18+,19-,23?/m0/s1
  • SMILES: CC1=CC2=C(S1)NC3=CC=CC=C3N=C2N4CC[N+](CC4)(C)OC5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O
  • Exact Mass: 505.17570
  • Molecular Formula: C23H29N4O7S+
  • Compound CID: pubchemlite136961881 pubchem136961881
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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