EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H32O5 |
| Net Charge | 0 |
| Average Mass | 352.471 |
| Monoisotopic Mass | 352.22497 |
| SMILES | CC(=O)/C=C/C1C(C)(O)C(OC(C)=O)C(O)C2C(C)(C)CCCC21C |
| InChI | InChI=1S/C20H32O5/c1-12(21)8-9-14-19(5)11-7-10-18(3,4)16(19)15(23)17(20(14,6)24)25-13(2)22/h8-9,14-17,23-24H,7,10-11H2,1-6H3/b9-8+ |
| InChIKey | ZFSCNCIWZXOGNL-CMDGGOBGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Sterebin C (CHEBI:175526) is a sesquiterpenoid (CHEBI:26658) |
| IUPAC Name |
|---|
| [1,3-dihydroxy-3,4a,8,8-tetramethyl-4-[(E)-3-oxobut-1-enyl]-2,4,5,6,7,8a-hexahydro-1H-naphthalen-2-yl] acetate |
| Manual Xrefs | Databases |
|---|---|
| 35013906 | ChemSpider |
| HMDB0035339 | HMDB |