benzylpenicillin_m4
- Other Name: (2R,4S)-2-[(1R)-2-(2,3-dihydroxypropoxy)-2-oxo-1-[(2-phenylacetyl)amino]ethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
- InChIKey: SLRXOKASXANNMU-XLMXVRBTSA-N
- InChI: InChI=1S/C19H26N2O7S/c1-19(2)15(17(25)26)21-16(29-19)14(18(27)28-10-12(23)9-22)20-13(24)8-11-6-4-3-5-7-11/h3-7,12,14-16,21-23H,8-10H2,1-2H3,(H,20,24)(H,25,26)/t12?,14-,15-,16+/m0/s1
- SMILES: CC1([C@@H](N[C@H](S1)[C@@H](C(=O)OCC(CO)O)NC(=O)CC2=CC=CC=C2)C(=O)O)C
- Exact Mass: 426.14607
- Molecular Formula: C19H26N2O7S
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Compound CID:
102263594
102263594
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.