CHEBI:64551 - fumiquinazoline C

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name fumiquinazoline C
ChEBI ID CHEBI:64551
Definition A fumiquinazoline obtained by oxidative spirocyclisation of fumiquinazoline A.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C24H21N5O4
Net Charge 0
Average Mass 443.45460
Monoisotopic Mass 443.15935
InChI InChI=1S/C24H21N5O4/c1-12-19(31)28-16-10-6-4-8-14(16)24(22(28)25-12)11-17-18(30)27-23(2,33-24)21-26-15-9-5-3-7-13(15)20(32)29(17)21/h3-10,12,17,22,25H,11H2,1-2H3,(H,27,30)/t12-,17+,22-,23-,24-/m0/s1
InChIKey POEYRUBMWIOMTB-LTQSKDJASA-N
SMILES [H][C@]12N[C@@H](C)C(=O)N1c1ccccc1[C@@]21C[C@@H]2C(=O)N[C@@](C)(O1)c1nc3ccccc3c(=O)n21
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing fumiquinazoline C (CHEBI:64551) is a azaspiro compound (CHEBI:35624)
fumiquinazoline C (CHEBI:64551) is a fumiquinazoline (CHEBI:64545)
fumiquinazoline C (CHEBI:64551) is a imidazoindole (CHEBI:64547)
fumiquinazoline C (CHEBI:64551) is a organic heteroheptacyclic compound (CHEBI:52157)
fumiquinazoline C (CHEBI:64551) is a oxaspiro compound (CHEBI:37948)
IUPAC Name
(1S,2'S,3S,5R,9a'S)-1,2'-dimethyl-1',9a'-dihydro-4H-spiro[1,5-(epiminomethano)[1,4]oxazepino[3,4-b]quinazoline-3,9'-imidazo[1,2-a]indole]-3',7,13(1H,2'H,5H)-trione
Registry Number Type Source
9096080 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
12530882 PubMed citation Europe PMC
21899262 PubMed citation Europe PMC
22319557 PubMed citation Europe PMC
Last Modified
10 May 2012