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CHEBI:210772 - Cottoquinazoline D
| Formula | C24H19N5O4 |
| Net Charge | 0 |
| Average Mass | 441.447 |
| Monoisotopic Mass | 441.14370 |
| SMILES | O=C1N[C@H]2c3nc4ccccc4c(=O)n3[C@@H]1C[C@@]1(O)c3ccccc3N3C(=O)C4(CC4)N2[C@@H]31 |
| InChI | InChI=1S/C24H19N5O4/c30-19-16-11-24(33)13-6-2-4-8-15(13)28-21(24)29(23(9-10-23)22(28)32)18(26-19)17-25-14-7-3-1-5-12(14)20(31)27(16)17/h1-8,16,18,21,33H,9-11H2,(H,26,30)/t16-,18-,21-,24-/m1/s1 |
| InChIKey | KDEIHABGQBSWKG-OVJGHYRJSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus (ncbitaxon:5052) | |||
| - | PubMed (21271733) | ||
| - | PubMed (27933898) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cottoquinazoline D (CHEBI:210772) is a quinazolines (CHEBI:38530) |
| IUPAC Names |
|---|
| (1R,12R,14R,27S)-12-hydroxyspiro[2,5,15,23,25-pentazaheptacyclo[12.10.2.12,5.06,11.015,24.017,22.012,27]heptacosa-6,8,10,17,19,21,23-heptaene-3,1'-cyclopropane]-4,16,26-trione |
| (1S,3S,12S,14S,27R)-3-[(2S)-butan-2-yl]-12-hydroxy-2,5,15,23,25-pentazaheptacyclo[12.10.2.12,5.06,11.015,24.017,22.012,27]heptacosa-6,8,10,17,19,21,23-heptaene-4,16,26-trione |