EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C35H56O11 |
| Net Charge | 0 |
| Average Mass | 652.822 |
| Monoisotopic Mass | 652.38226 |
| SMILES | CC(C)[C@@H]1OC(=O)/C=C/C=C/C=C/C=C/[C@H]2O[C@H](C[C@H](O)C[C@H](O)C[C@H](O)C[C@@H](O)C[C@H](O)C[C@@H](O)C[C@@H](O)/C=C/[C@@H]1C)C[C@H]2O |
| InChI | InChI=1S/C35H56O11/c1-22(2)35-23(3)12-13-24(36)14-25(37)15-26(38)16-27(39)17-28(40)18-29(41)19-30(42)20-31-21-32(43)33(45-31)10-8-6-4-5-7-9-11-34(44)46-35/h4-13,22-33,35-43H,14-21H2,1-3H3/b6-4+,7-5+,10-8+,11-9+,13-12+/t23-,24-,25-,26+,27-,28+,29+,30+,31+,32+,33+,35-/m0/s1 |
| InChIKey | HSZPYJSFSMYNDZ-UMBNYJRTSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (28490799) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Flavofungin VIII (CHEBI:206907) is a macrolide (CHEBI:25106) |
| IUPAC Name |
|---|
| (1R,2E,4E,6E,8E,12S,13S,14E,16R,18R,20S,22R,24R,26R,28R,30R,32R)-16,18,20,22,24,26,28,32-octahydroxy-13-methyl-12-propan-2-yl-11,33-dioxabicyclo[28.2.1]tritriaconta-2,4,6,8,14-pentaen-10-one |
| Manual Xrefs | Databases |
|---|---|
| 61708637 | ChemSpider |