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CHEBI:199489 - Asterriquinone SU-5500

ChEBI IDCHEBI:199489
ChEBI NameAsterriquinone SU-5500
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H32N2O5
Net Charge0
Average Mass548.639
Monoisotopic Mass548.23112
SMILESCC(=O)OC1=C(c2c(CC=C(C)C)nc3ccccc23)C(=O)C(O)=C(c2c(CC=C(C)C)nc3ccccc23)C1=O
InChIInChI=1S/C34H32N2O5/c1-18(2)14-16-25-27(21-10-6-8-12-23(21)35-25)29-31(38)32(39)30(34(33(29)40)41-20(5)37)28-22-11-7-9-13-24(22)36-26(28)17-15-19(3)4/h6-15,35-36,38H,16-17H2,1-5H3
InChIKeyGLHSYPGYNYXAQE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus candidus (ncbitaxon:41067) - PubMed (10348035)
ChEBI Ontology
Outgoing Relation(s)
Asterriquinone SU-5500 (CHEBI:199489) is a indoles (CHEBI:24828)
IUPAC Name 
[4-hydroxy-2,5-bis[2-(3-methylbut-2-enyl)-1H-indol-3-yl]-3,6-dioxocyclohexa-1,4-dien-1-yl] acetate
Manual XrefsDatabases
9015660ChemSpider