EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H26O2 |
| Net Charge | 0 |
| Average Mass | 238.371 |
| Monoisotopic Mass | 238.19328 |
| SMILES | CC1=C(CO)[C@@]2(C)CCCC(C)(C)[C@@H]2C[C@H]1O |
| InChI | InChI=1S/C15H26O2/c1-10-11(9-16)15(4)7-5-6-14(2,3)13(15)8-12(10)17/h12-13,16-17H,5-9H2,1-4H3/t12-,13+,15-/m1/s1 |
| InChIKey | SVWKODBBWFMLHM-VNHYZAJKSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Diaporthespecies (ncbitaxon:1756133) | - | PubMed (23006147) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Diaporol E (CHEBI:217324) is a secondary alcohol (CHEBI:35681) |
| IUPAC Name |
|---|
| (2R,4aS,8aS)-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-1,2,5,6,7,8a-hexahydronaphthalen-2-ol |
| Manual Xrefs | Databases |
|---|---|
| 28669208 | ChemSpider |