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CHEBI:206119 - Versiquinazoline E

ChEBI IDCHEBI:206119
ChEBI NameVersiquinazoline E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H21N5O4
Net Charge0
Average Mass443.463
Monoisotopic Mass443.15935
SMILESO=C1NCc2nc3ccccc3c(=O)n2[C@H]1C[C@]1(O)c2ccccc2N2C(=O)C3(CC3)N[C@H]21
InChIInChI=1S/C24H21N5O4/c30-19-17(28-18(12-25-19)26-15-7-3-1-5-13(15)20(28)31)11-24(33)14-6-2-4-8-16(14)29-21(24)27-23(9-10-23)22(29)32/h1-8,17,21,27,33H,9-12H2,(H,25,30)/t17-,21+,24-/m0/s1
InChIKeyDNBXNSJGLBAFPT-UQJUWTFNSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (27933898)
ChEBI Ontology
Outgoing Relation(s)
Versiquinazoline E (CHEBI:206119) is a quinazolines (CHEBI:38530)
IUPAC Name 
(4S)-4-[[(3aR,4S)-4-hydroxy-1-oxospiro[3,3a-dihydroimidazo[1,2-a]indole-2,1'-cyclopropane]-4-yl]methyl]-2,4-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione
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76789944ChemSpider