Main compound image
(2s)-14-o-beta-d-glucuronylpterosin a
  • Other Name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[2-[(2S)-2-(hydroxymethyl)-2,4,6-trimethyl-3-oxo-1H-inden-5-yl]ethoxy]oxane-2-carboxylic acid
  • InChIKey: DTPWYUAUCFZJHT-OBEJHBQOSA-N
  • InChI: InChI=1S/C21H28O9/c1-9-6-11-7-21(3,8-22)18(26)13(11)10(2)12(9)4-5-29-20-16(25)14(23)15(24)17(30-20)19(27)28/h6,14-17,20,22-25H,4-5,7-8H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,20+,21-/m0/s1
  • SMILES: CC1=CC2=C(C(=C1CCO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)C)C(=O)[C@](C2)(C)CO
  • Exact Mass: 424.17333
  • Molecular Formula: C21H28O9
  • Compound CID: pubchemlite118753006 pubchem118753006
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.

Neighbours
All in View
Loading...