EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H16O6 |
| Net Charge | 0 |
| Average Mass | 364.353 |
| Monoisotopic Mass | 364.09469 |
| SMILES | O=C1C[C@](O)(c2ccccc2)[C@@H](c2cc(O)cc(=O)o2)c2cccc(O)c21 |
| InChI | InChI=1S/C21H16O6/c22-13-9-17(27-18(25)10-13)20-14-7-4-8-15(23)19(14)16(24)11-21(20,26)12-5-2-1-3-6-12/h1-10,20,22-23,26H,11H2/t20-,21+/m1/s1 |
| InChIKey | ANQCWAZGTFETKF-RTWAWAEBSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces maritimus (ncbitaxon:115828) | - | DOI (10.1021/ja000445n) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Wailupemycin D (CHEBI:207224) is a benzenes (CHEBI:22712) |
| Wailupemycin D (CHEBI:207224) is a naphthalenes (CHEBI:25477) |
| Wailupemycin D (CHEBI:207224) is a ring assembly (CHEBI:36820) |
| IUPAC Name |
|---|
| 6-[(1S,2R)-2,5-dihydroxy-4-oxo-2-phenyl-1,3-dihydronaphthalen-1-yl]-4-hydroxypyran-2-one |
| Manual Xrefs | Databases |
|---|---|
| 78440229 | ChemSpider |