EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H33NO2S |
| Net Charge | 0 |
| Average Mass | 351.556 |
| Monoisotopic Mass | 351.22320 |
| SMILES | CC[C@@H](O)[C@@H](C)CCC/C(C)=C\C[C@H](O)/C(C)=C/c1csc(C)n1 |
| InChI | InChI=1S/C20H33NO2S/c1-6-19(22)15(3)9-7-8-14(2)10-11-20(23)16(4)12-18-13-24-17(5)21-18/h10,12-13,15,19-20,22-23H,6-9,11H2,1-5H3/b14-10-,16-12+/t15-,19+,20-/m0/s1 |
| InChIKey | QLPPQPNJLHXPOV-KTZDFZCUSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Sorangium cellulosum (ncbitaxon:56) | - | PubMed (11473410) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (1Z,3S,5E,10S,11R)-2,6,10-trimethyl-1-(2-methylthiazol-4-yl)trideca-1,5-diene-3,11-diol (CHEBI:204981) is a sesquiterpenoid (CHEBI:26658) |
| IUPAC Name |
|---|
| (1E,3S,5Z,10S,11R)-2,6,10-trimethyl-1-(2-methyl-1,3-thiazol-4-yl)trideca-1,5-diene-3,11-diol |
| Manual Xrefs | Databases |
|---|---|
| 78436165 | ChemSpider |