EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C34H28O14 |
| Net Charge | 0 |
| Average Mass | 660.584 |
| Monoisotopic Mass | 660.14791 |
| SMILES | COC(=O)C1=CC(=O)C=C(OC)[C@]12Oc1cc(C)cc(OC(=O)c3c(O)cc(C)cc3Oc3c(OC)cc(O)cc3C(=O)OC)c1C2=O |
| InChI | InChI=1S/C34H28O14/c1-15-7-21(37)27(22(8-15)46-29-19(31(39)44-5)11-17(35)13-25(29)42-3)33(41)47-23-9-16(2)10-24-28(23)30(38)34(48-24)20(32(40)45-6)12-18(36)14-26(34)43-4/h7-14,35,37H,1-6H3/t34-/m1/s1 |
| InChIKey | GNHQZFDQZNRWBS-UUWRZZSWSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Geomycesspecies (ncbitaxon:1715258) | - | PubMed (18720971) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Geomycin C (CHEBI:218077) is a aromatic ether (CHEBI:35618) |
| IUPAC Name |
|---|
| methyl (2R)-4-[2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoyl]oxy-5'-methoxy-6-methyl-3,3'-dioxospiro[1-benzouran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate |
| Manual Xrefs | Databases |
|---|---|
| 24712973 | ChemSpider |