EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H14O7 |
| Net Charge | 0 |
| Average Mass | 366.325 |
| Monoisotopic Mass | 366.07395 |
| SMILES | O=C1C[C@@H](O)[C@]2(Oc3cccc4c(O)ccc(c34)O2)c2c(O)ccc(O)c21 |
| InChI | InChI=1S/C20H14O7/c21-10-6-7-15-17-9(10)2-1-3-14(17)26-20(27-15)16(25)8-13(24)18-11(22)4-5-12(23)19(18)20/h1-7,16,21-23,25H,8H2/t16-,20-/m1/s1 |
| InChIKey | KGZLWNLQQVXESZ-OXQOHEQNSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Lasiodiplodia (ncbitaxon:66739) | - | DOI (10.1002/hlca.201300436) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Palmarumycin LP1 (CHEBI:207407) is a naphthols (CHEBI:25392) |
| IUPAC Name |
|---|
| (3R,4S)-3,5,8,8'-tetrahydroxyspiro[2,3-dihydronaphthalene-4,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene]-1-one |
| Manual Xrefs | Databases |
|---|---|
| 78438420 | ChemSpider |