EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H24O4 |
| Net Charge | 0 |
| Average Mass | 268.353 |
| Monoisotopic Mass | 268.16746 |
| SMILES | COC(=O)C1=C[C@H]2[C@@H](OC1)[C@@H](CO)CC[C@@H]2C(C)C |
| InChI | InChI=1S/C15H24O4/c1-9(2)12-5-4-10(7-16)14-13(12)6-11(8-19-14)15(17)18-3/h6,9-10,12-14,16H,4-5,7-8H2,1-3H3/t10-,12-,13-,14+/m1/s1 |
| InChIKey | YZLDOIXXMJWGNH-ZRJCITRHSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Trichoderma (ncbitaxon:5543) | - | PubMed (32861754) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Trichocadinin J (CHEBI:214163) is a monoterpenoid (CHEBI:25409) |
| IUPAC Name |
|---|
| methyl (4aS,5R,8R,8aR)-8-(hydroxymethyl)-5-propan-2-yl-4a,5,6,7,8,8a-hexahydro-2H-chromene-3-carboxylate |
| Manual Xrefs | Databases |
|---|---|
| 98309180 | ChemSpider |