EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H12N2O3 |
| Net Charge | 0 |
| Average Mass | 244.250 |
| Monoisotopic Mass | 244.08479 |
| SMILES | O=c1cc2c3c(ccn2CCCO)cnc3c1O |
| InChI | InChI=1S/C13H12N2O3/c16-5-1-3-15-4-2-8-7-14-12-11(8)9(15)6-10(17)13(12)18/h2,4,6-7,16,18H,1,3,5H2 |
| InChIKey | XTPMTFLWJNEQHQ-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mycena haematopus (ncbitaxon:230807) | - | PubMed (29637640) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Mycenaflavin B (CHEBI:214889) is a pyrroloquinoline (CHEBI:50918) |
| IUPAC Name |
|---|
| 11-hydroxy-7-(3-hydroxypropyl)-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(11),2,4(12),5,8-pentaen-10-one |