EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H20N2O3 |
| Net Charge | 0 |
| Average Mass | 336.391 |
| Monoisotopic Mass | 336.14739 |
| SMILES | C[C@H]1CC(=O)N2[C@H](O1)c1c(cc3cccc4c3c1C(=O)N4C)C2(C)C |
| InChI | InChI=1S/C20H20N2O3/c1-10-8-14(23)22-19(25-10)16-12(20(22,2)3)9-11-6-5-7-13-15(11)17(16)18(24)21(13)4/h5-7,9-10,19H,8H2,1-4H3/t10-,19+/m0/s1 |
| InChIKey | XDZIYWBMRDSUPM-APBUJDDRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus oryzae (ncbitaxon:5062) | - | PubMed (29271645) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Asperorydine E (CHEBI:219048) is a isoindoles (CHEBI:24897) |
| IUPAC Name |
|---|
| (3R,5S)-5,9,9,17-tetramethyl-4-oxa-8,17-diazapentacyclo[10.6.1.02,10.03,8.016,19]nonadeca-1(19),2(10),11,13,15-pentaene-7,18-dione |
| Manual Xrefs | Databases |
|---|---|
| 78439492 | ChemSpider |