(s)-2-amino-5-((r)-3-(2-amino-9-((4-hydroxy-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-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]purin-6-yl]sulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
- InChIKey: BYFHBBATFYWREY-JSGCOSHPSA-N
- InChI: InChI=1S/C23H29N9O7S/c1-10-5-26-13(11(2)18(10)36)7-32-9-28-17-19(32)30-23(25)31-21(17)40-8-14(20(37)27-6-16(34)35)29-15(33)4-3-12(24)22(38)39/h5,9,12,14H,3-4,6-8,24H2,1-2H3,(H,26,36)(H,27,37)(H,29,33)(H,34,35)(H,38,39)(H2,25,30,31)/t12-,14-/m0/s1
- SMILES: CC1=CNC(=C(C1=O)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: 575.19107
- Molecular Formula: C23H29N9O7S
-
Compound CID:
118753344
118753344
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.