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CHEBI:197780 - Asterriquinone CT2

ChEBI IDCHEBI:197780
ChEBI NameAsterriquinone CT2
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H28N2O4
Net Charge0
Average Mass504.586
Monoisotopic Mass504.20491
SMILESC=C(C)/C=C/c1ccc2c(C3=C(O)C(=O)C(c4cnc5cc(CC=C(C)C)ccc45)=C(O)C3=O)cnc2c1
InChIInChI=1S/C32H28N2O4/c1-17(2)5-7-19-9-11-21-23(15-33-25(21)13-19)27-29(35)31(37)28(32(38)30(27)36)24-16-34-26-14-20(8-6-18(3)4)10-12-22(24)26/h5-7,9-16,33-35,38H,1,8H2,2-4H3/b7-5+
InChIKeyXUNIIULIATZTPL-FNORWQNLSA-N
Species of MetaboliteComponentSourceComments
Botryotrichumspecies (ncbitaxon:2040710) - PubMed (8931717)
ChEBI Ontology
Outgoing Relation(s)
Asterriquinone CT2 (CHEBI:197780) is a indoles (CHEBI:24828)
IUPAC Name 
2,5-dihydroxy-3-[6-[(1E)-3-methylbuta-1,3-dienyl]-1H-indol-3-yl]-6-[6-(3-methylbut-2-enyl)-1H-indol-3-yl]cyclohexa-2,5-diene-1,4-dione
Manual XrefsDatabases
8181898ChemSpider