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CHEBI:201584 - Paeciloquinone D

ChEBI IDCHEBI:201584
ChEBI NamePaeciloquinone D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H14O9
Net Charge0
Average Mass374.301
Monoisotopic Mass374.06378
SMILESO=C1c2cc(O)cc(O)c2C(=O)c2c1cc(O)c([C@@H](CCO)C(=O)O)c2O
InChIInChI=1S/C18H14O9/c19-2-1-7(18(26)27)12-11(22)5-9-14(16(12)24)17(25)13-8(15(9)23)3-6(20)4-10(13)21/h3-5,7,19-22,24H,1-2H2,(H,26,27)/t7-/m1/s1
InChIKeyNSSMDOWGNWOYJY-SSDOTTSWSA-N
Species of MetaboliteComponentSourceComments
Paecilomyces (ncbitaxon:33202) - PubMed (7730151)
ChEBI Ontology
Outgoing Relation(s)
Paeciloquinone D (CHEBI:201584) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
4-hydroxy-2-(1,3,6,8-tetrahydroxy-9,10-dioxoanthracen-2-yl)butanoic acid
Manual XrefsDatabases
8649939ChemSpider