(s)-2-amino-5-((r)-3-(2-amino-9-((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)-9h-purin-6-ylthio)-1-(carboxymethylamino)-1-oxopropan-2-ylamino)-5-oxopentanoic acid
- Other Name: (2S)-2-amino-5-[[(2R)-3-[2-amino-9-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]purin-6-yl]sulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
- InChIKey: HCWKFWHRTPRJCB-ZFWWWQNUSA-N
- InChI: InChI=1S/C24H31N9O7S/c1-11-6-27-14(12(2)19(11)40-3)8-33-10-29-18-20(33)31-24(26)32-22(18)41-9-15(21(37)28-7-17(35)36)30-16(34)5-4-13(25)23(38)39/h6,10,13,15H,4-5,7-9,25H2,1-3H3,(H,28,37)(H,30,34)(H,35,36)(H,38,39)(H2,26,31,32)/t13-,15-/m0/s1
- SMILES: CC1=CN=C(C(=C1OC)C)CN2C=NC3=C2N=C(N=C3SC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)N
- Exact Mass: 589.20672
- Molecular Formula: C24H31N9O7S
-
Compound CID:
118753017
118753017
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.