EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C45H82O5 |
| Net Charge | 0 |
| Average Mass | 703.146 |
| Monoisotopic Mass | 702.61623 |
| SMILES | C=CC(C)(O)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCC=C(C)C |
| InChI | InChI=1S/C45H82O5/c1-12-41(7,46)28-16-26-39(5)24-13-22-38(4)23-14-25-40(6)27-17-30-43(9,48)32-19-34-45(11,50)36-20-35-44(10,49)33-18-31-42(8,47)29-15-21-37(2)3/h12,21-22,25-26,46-50H,1,13-20,23-24,27-36H2,2-11H3/b38-22+,39-26+,40-25+ |
| InChIKey | GPDSPOXDCDDXJY-KVWZZRTCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Hypsizygus marmoreus (ncbitaxon:39966) | - | PubMed (10563937) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Hypsiziprenol-C9 (CHEBI:211354) is a polyterpenoid (CHEBI:26207) |
| IUPAC Name |
|---|
| (6E,10E,14E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-1,6,10,14,34-pentaene-3,19,23,27,31-pentol |
| Manual Xrefs | Databases |
|---|---|
| 9753235 | ChemSpider |