EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H21N5O4 |
| Net Charge | 0 |
| Average Mass | 443.463 |
| Monoisotopic Mass | 443.15935 |
| SMILES | C[C@@H]1N[C@H]2N(C1=O)c1ccccc1[C@@]21C[C@H]2C(=O)N(C)[C@H](O1)c1nc3ccccc3c(=O)n12 |
| InChI | InChI=1S/C24H21N5O4/c1-12-19(30)29-16-10-6-4-8-14(16)24(23(29)25-12)11-17-21(32)27(2)22(33-24)18-26-15-9-5-3-7-13(15)20(31)28(17)18/h3-10,12,17,22-23,25H,11H2,1-2H3/t12-,17-,22+,23-,24-/m0/s1 |
| InChIKey | BOZGEGDMHAOPIQ-JNMZTHFISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus fischeri NRRL 181 (ncbitaxon:331117) | - | DOI (10.1002/hlca.201400270) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cottoquinazoline F (CHEBI:204154) is a quinazolines (CHEBI:38530) |
| IUPAC Name |
|---|
| (1S,2'S,3'aS,12R,14S)-2',17-dimethylspiro[13-oxa-2,10,17-triazatetracyclo[10.3.2.02,11.04,9]heptadeca-4,6,8,10-tetraene-14,4'-3,3a-dihydro-2H-imidazo[1,2-a]indole]-1',3,16-trione |
| Manual Xrefs | Databases |
|---|---|
| 78440980 | ChemSpider |