3-hydroxybenzo[a]pyrene
- Other Name: 14-Oxahexacyclo[10.7.2.02,7.09,20.013,15.017,21]henicosa-1(20),2,4,6,8,10,12(21),16,18-nonaene
- InChIKey: HIWUMYIKMBIYMX-UHFFFAOYSA-N
- InChI: InChI=1S/C20H12O/c1-2-4-14-11(3-1)9-12-6-8-16-19-13(10-17-20(16)21-17)5-7-15(14)18(12)19/h1-10,17,20H
- SMILES: C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC6C5O6)C=C3
- Exact Mass: 268.08882
- Molecular Formula: C20H12O
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Compound CID:
154699641
154699641
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.
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.