EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C28H21NO9 |
| Net Charge | 0 |
| Average Mass | 515.474 |
| Monoisotopic Mass | 515.12163 |
| SMILES | C[C@H]1C(=O)[C@H](O)[C@H]2c3ccccc3[C@@H]3Nc4c(cc(O)c5c4C(=O)c4c(O)ccc(O)c4C5=O)[C@@]2(O)[C@]13O |
| InChI | InChI=1S/C28H21NO9/c1-9-22(33)25(36)20-10-4-2-3-5-11(10)26-27(9,37)28(20,38)12-8-15(32)18-19(21(12)29-26)24(35)17-14(31)7-6-13(30)16(17)23(18)34/h2-9,20,25-26,29-32,36-38H,1H3/t9-,20+,25+,26-,27-,28-/m0/s1 |
| InChIKey | SMIPWYWDEUZLFV-BBURVQHASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Micromonospora (ncbitaxon:1873) | - | PubMed (1955384) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Dynemicin P (CHEBI:221348) is a anthraquinone (CHEBI:22580) |
| IUPAC Name |
|---|
| (2R,3S,4R,6R,7R,14S)-2,3,6,20,23,27-hexahydroxy-4-methyl-15-azaheptacyclo[14.12.0.02,7.03,14.08,13.017,26.019,24]octacosa-1(28),8,10,12,16,19,21,23,26-nonaene-5,18,25-trione |
| Manual Xrefs | Databases |
|---|---|
| 78442916 | ChemSpider |