EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H20N2O7S |
| Net Charge | 0 |
| Average Mass | 432.454 |
| Monoisotopic Mass | 432.09912 |
| SMILES | CSc1ccc(C(=O)O)c2nc3cccc(O[C@@H]4O[C@H](C)[C@H](O)[C@@H](O)[C@H]4O)c3nc12 |
| InChI | InChI=1S/C20H20N2O7S/c1-8-16(23)17(24)18(25)20(28-8)29-11-5-3-4-10-14(11)22-15-12(30-2)7-6-9(19(26)27)13(15)21-10/h3-8,16-18,20,23-25H,1-2H3,(H,26,27)/t8-,16+,17-,18-,20+/m1/s1 |
| InChIKey | VGDKDGBMEZJAMP-TYZSUWMVSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (21304533) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Izuminoside B (CHEBI:219737) is a glycoside (CHEBI:24400) |
| IUPAC Name |
|---|
| 4-methylsulanyl-6-[(2S,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenazine-1-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 78437635 | ChemSpider |