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CHEBI:192553 - didemethylasterriquinone D(1−)

ChEBI IDCHEBI:192553
ChEBI Namedidemethylasterriquinone D(1−)
Stars
ASCII Namedidemethylasterriquinone D(1-)
DefinitionA bisindole alkaloid that is quinone bearing two hydroxy substituents at position 2 and 5 and two indol-3-yl groups at positions 3 and 6; major microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC22H13N2O4
Net Charge-1
Average Mass369.356
Monoisotopic Mass369.08808
SMILESO=C1C(O)=C(c2cnc3ccccc23)C(=O)C([O-])=C1c1cnc2ccccc12
InChIInChI=1S/C22H14N2O4/c25-19-17(13-9-23-15-7-3-1-5-11(13)15)20(26)22(28)18(21(19)27)14-10-24-16-8-4-2-6-12(14)16/h1-10,23-25,28H/p-1
InChIKeyHNGJGZFTQRJUIF-UHFFFAOYSA-M
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
didemethylasterriquinone D(1−) (CHEBI:192553) is a 1,4-benzoquinones (CHEBI:132124)
didemethylasterriquinone D(1−) (CHEBI:192553) is a bisindole alkaloid (CHEBI:51879)
Synonyms  Source
3,6-dihydroxy-2,5-diindol-3'-yl-1,4-benzoquinoneSUBMITTER
DDAQ DSUBMITTER
UniProt Name  Source
didemethylasterriquinone DUniProt
Manual XrefsDatabases
CPD-16844MetaCyc
Citations