EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C30H51NO8 |
| Net Charge | 0 |
| Average Mass | 553.737 |
| Monoisotopic Mass | 553.36147 |
| SMILES | CCC1OC(=O)CC(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(=O)/C=C/C2(C)OC2C1C |
| InChI | InChI=1S/C30H51NO8/c1-10-24-20(6)28-30(7,39-28)12-11-22(32)16(2)13-17(3)27(19(5)23(33)15-25(34)37-24)38-29-26(35)21(31(8)9)14-18(4)36-29/h11-12,16-21,23-24,26-29,33,35H,10,13-15H2,1-9H3/b12-11+ |
| InChIKey | NMAABBNXENXPAD-VAWYXSNFSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Micromonospora chalcea (ncbitaxon:1874) | - | PubMed (993104) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (14E)-9-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-7-hydroxy-2,8,10,12,16-pentamethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-ene-5,13-dione (CHEBI:219371) is a aminoglycoside (CHEBI:47779) |
| IUPAC Name |
|---|
| (14E)-9-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-7-hydroxy-2,8,10,12,16-pentamethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-ene-5,13-dione |
| Manual Xrefs | Databases |
|---|---|
| 4950062 | ChemSpider |