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CHEBI:200817 - Asterriquinone monoacetate

ChEBI IDCHEBI:200817
ChEBI NameAsterriquinone monoacetate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC34H32N2O5
Net Charge0
Average Mass548.639
Monoisotopic Mass548.23112
SMILESC=CC(C)(C)n1cc(C2=C(O)C(=O)C(c3cn(C(C)(C)C=C)c4ccccc34)=C(OC(C)=O)C2=O)c2ccccc21
InChIInChI=1S/C34H32N2O5/c1-8-33(4,5)35-18-23(21-14-10-12-16-25(21)35)27-29(38)30(39)28(32(31(27)40)41-20(3)37)24-19-36(34(6,7)9-2)26-17-13-11-15-22(24)26/h8-19,38H,1-2H2,3-7H3
InChIKeyUGDNNEPDNMTIIF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (7954921)
ChEBI Ontology
Outgoing Relation(s)
Asterriquinone monoacetate (CHEBI:200817) is a indoles (CHEBI:24828)
IUPAC Name 
[4-hydroxy-2,5-bis[1-(2-methylbut-3-en-2-yl)indol-3-yl]-3,6-dioxocyclohexa-1,4-dien-1-yl] acetate
Manual XrefsDatabases
341544ChemSpider