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CHEBI:216816 - AAL Toxin Td2
| Formula | C27H49NO10 |
| Net Charge | 0 |
| Average Mass | 547.686 |
| Monoisotopic Mass | 547.33565 |
| SMILES | CCC(C)C(OC(=O)CC(CC(=O)O)C(=O)O)C(O)CC(C)CCCCCCC(O)CC(O)CNC(C)=O |
| InChI | InChI=1S/C27H49NO10/c1-5-18(3)26(38-25(35)14-20(27(36)37)13-24(33)34)23(32)12-17(2)10-8-6-7-9-11-21(30)15-22(31)16-28-19(4)29/h17-18,20-23,26,30-32H,5-16H2,1-4H3,(H,28,29)(H,33,34)(H,36,37) |
| InChIKey | SHYASWXLCRZPLI-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Alternaria alternata f.species lycopersici (ncbitaxon:1261141) | - | DOI (10.1021/jf00038a018) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| AAL Toxin Td2 (CHEBI:216816) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| 2-[2-(17-acetamido-5,14,16-trihydroxy-3,7-dimethylheptadecan-4-yl)oxy-2-oxoethyl]butanedioic acid |
| Manual Xrefs | Databases |
|---|---|
| 8568159 | ChemSpider |