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CHEBI:222062 - Asperlicin D
| Formula | C25H18N4O2 |
| Net Charge | 0 |
| Average Mass | 406.445 |
| Monoisotopic Mass | 406.14298 |
| SMILES | O=C1Nc2ccccc2-c2nc3ccccc3c(=O)n2[C@H]1Cc1cnc2ccccc12 |
| InChI | InChI=1S/C25H18N4O2/c30-24-22(13-15-14-26-19-10-4-1-7-16(15)19)29-23(17-8-2-5-11-20(17)28-24)27-21-12-6-3-9-18(21)25(29)31/h1-12,14,22,26H,13H2,(H,28,30)/t22-/m0/s1 |
| InChIKey | TTYFXJZDLYVOTG-QFIPXVFZSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus (ncbitaxon:5052) | - | PubMed (3417562) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Asperlicin D (CHEBI:222062) is a pyrimidodiazepine (CHEBI:39306) |
| IUPAC Name |
|---|
| (7S)-7-(1H-indol-3-ylmethyl)-5,7-dihydroquinazolino[3,2-d][1,4]benzodiazepine-6,9-dione |
| Manual Xrefs | Databases |
|---|---|
| 20129798 | ChemSpider |