elvitegravir metabolite m23
- Other Name: Elvitegravir metabolite M23
- InChIKey: GYKQBLWUYPRFJK-BUSAMCBKSA-N
- InChI: InChI=1S/C29H31ClFNO12/c1-11(2)17(10-33)32-9-15(27(38)39)20(34)14-8-13(7-12-5-4-6-16(30)18(12)31)24(42-3)25(19(14)32)43-29-23(37)21(35)22(36)26(44-29)28(40)41/h4-6,8-9,11,17,21-23,26,29,33,35-37H,7,10H2,1-3H3,(H,38,39)(H,40,41)/t17-,21?,22?,23?,26?,29?/m1/s1
- SMILES: CC(C)[C@@H](CO)N1C=C(C(=O)C2=C1C(=C(C(=C2)CC3=C(C(=CC=C3)Cl)F)OC)OC4C(C(C(C(O4)C(=O)O)O)O)O)C(=O)O
- Exact Mass: 639.15188
- Molecular Formula: C29H31ClFNO12
-
Compound CID:
169501883
169501883
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.