EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:210827 - Trichobisabolin D
| Formula | C16H28O3 |
| Net Charge | 0 |
| Average Mass | 268.397 |
| Monoisotopic Mass | 268.20384 |
| SMILES | CC(=O)OC(C)CCC[C@@H](C)[C@H]1C=C[C@@](C)(O)CC1 |
| InChI | InChI=1S/C16H28O3/c1-12(6-5-7-13(2)19-14(3)17)15-8-10-16(4,18)11-9-15/h8,10,12-13,15,18H,5-7,9,11H2,1-4H3/t12-,13?,15+,16-/m1/s1 |
| InChIKey | VDIBVWMHMSHSRS-RRZQYYKNSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Trichoderma (ncbitaxon:5543) | - | PubMed (30878292) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Trichobisabolin D (CHEBI:210827) is a p-menthane monoterpenoid (CHEBI:25186) |
| IUPAC Name |
|---|
| [(6R)-6-[(1S,4S)-4-hydroxy-4-methylcyclohex-2-en-1-yl]heptan-2-yl] acetate |
| Manual Xrefs | Databases |
|---|---|
| 77001457 | ChemSpider |