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CHEBI:177946 - 1-(3-Carboxypropyl)-3,7-dimethylxanthine
| Formula | C11H14N4O4 |
| Net Charge | 0 |
| Average Mass | 266.257 |
| Monoisotopic Mass | 266.10150 |
| SMILES | Cn1cnc2c1c(=O)n(CCCC(=O)O)c(=O)n2C |
| InChI | InChI=1S/C11H14N4O4/c1-13-6-12-9-8(13)10(18)15(11(19)14(9)2)5-3-4-7(16)17/h6H,3-5H2,1-2H3,(H,16,17) |
| InChIKey | WKASGTGXOGALBG-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Bombyx mori (ncbitaxon:7091) | hemolymph (BTO:0000572) | MetaboLights (MTBLS3247) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(3-Carboxypropyl)-3,7-dimethylxanthine (CHEBI:177946) is a oxopurine (CHEBI:25810) |
| IUPAC Name |
|---|
| 4-(3,7-dimethyl-2,6-dioxopurin-1-yl)butanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 133451 | ChemSpider |