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CHEBI:203340 - Paeciloquinone F

ChEBI IDCHEBI:203340
ChEBI NamePaeciloquinone F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H14O9
Net Charge0
Average Mass398.323
Monoisotopic Mass398.06378
SMILESC[C@]12CC[C@](C(=O)O)(O1)c1c(cc3c(c1O)C(=O)c1c(O)cc(O)cc1C3=O)O2
InChIInChI=1S/C20H14O9/c1-19-2-3-20(29-19,18(26)27)14-11(28-19)6-9-13(17(14)25)16(24)12-8(15(9)23)4-7(21)5-10(12)22/h4-6,21-22,25H,2-3H2,1H3,(H,26,27)/t19-,20+/m1/s1
InChIKeyVFXZFYHLJCNYMX-UXHICEINSA-N
Species of MetaboliteComponentSourceComments
Paecilomyces (ncbitaxon:33202) - PubMed (7730151)
ChEBI Ontology
Outgoing Relation(s)
Paeciloquinone F (CHEBI:203340) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
(1S,17R)-3,7,9-trihydroxy-17-methyl-5,12-dioxo-16,20-dioxapentacyclo[15.2.1.02,15.04,13.06,11]icosa-2(15),3,6(11),7,9,13-hexaene-1-carboxylic acid
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78439658ChemSpider