mefenamyl-s-acy-coenzyme a
- Other Name: S-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 2-(2,3-dimethylanilino)benzenecarbothioate
- InChIKey: PIUWXHGKQDOBPS-OGLMRXNDSA-N
- InChI: InChI=1S/C36H49N8O17P3S/c1-20-8-7-11-23(21(20)2)43-24-10-6-5-9-22(24)35(49)65-15-14-38-26(45)12-13-39-33(48)30(47)36(3,4)17-58-64(55,56)61-63(53,54)57-16-25-29(60-62(50,51)52)28(46)34(59-25)44-19-42-27-31(37)40-18-41-32(27)44/h5-11,18-19,25,28-30,34,43,46-47H,12-17H2,1-4H3,(H,38,45)(H,39,48)(H,53,54)(H,55,56)(H2,37,40,41)(H2,50,51,52)/t25-,28-,29-,30?,34-/m1/s1
- SMILES: CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)OP(=O)(O)O)O)C
- Exact Mass: 990.21492
- Molecular Formula: C36H49N8O17P3S
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Compound CID:
118753104
118753104
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.