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CHEBI:225498 - Quinadoline A

ChEBI IDCHEBI:225498
ChEBI NameQuinadoline A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H27N5O4
Net Charge0
Average Mass485.544
Monoisotopic Mass485.20630
SMILESCC(C)=C1NC(=O)C(CC2(O)c3ccccc3N3C(=O)C(C)(C)NC32)n2c1nc1ccccc1c2=O
InChIInChI=1S/C27H27N5O4/c1-14(2)20-21-28-17-11-7-5-9-15(17)23(34)31(21)19(22(33)29-20)13-27(36)16-10-6-8-12-18(16)32-24(27)30-26(3,4)25(32)35/h5-12,19,24,30,36H,13H2,1-4H3,(H,29,33)
InChIKeyLCHQPVCRYDVSTJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (18922003)
ChEBI Ontology
Outgoing Relation(s)
Quinadoline A (CHEBI:225498) is a quinazolines (CHEBI:38530)
IUPAC Name 
4-[(4-hydroxy-2,2-dimethyl-1-oxo-3,3a-dihydroimidazo[1,2-a]indol-4-yl)methyl]-1-propan-2-ylidene-4H-pyrazino[2,1-b]quinazoline-3,6-dione
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78443653ChemSpider