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CHEBI:202357 - Rubiginosin C

ChEBI IDCHEBI:202357
ChEBI NameRubiginosin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H38O6
Net Charge0
Average Mass470.606
Monoisotopic Mass470.26684
SMILESCCCCCCCCC/C=C/C=C(\C)C(=O)O[C@@]1(C)C(=O)C=C2C=C(CC(C)O)OC=C2C1=O
InChIInChI=1S/C28H38O6/c1-5-6-7-8-9-10-11-12-13-14-15-20(2)27(32)34-28(4)25(30)18-22-17-23(16-21(3)29)33-19-24(22)26(28)31/h13-15,17-19,21,29H,5-12,16H2,1-4H3/b14-13+,20-15+/t21?,28-/m0/s1
InChIKeyTYZWBYXLNZVGMK-CTMKRBNKSA-N
Species of MetaboliteComponentSourceComments
Hypoxylon rubiginosum (ncbitaxon:110542) - PubMed (15270570)
Roles Classification
Biological Role:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
Rubiginosin C (CHEBI:202357) is a azaphilone (CHEBI:50941)
IUPAC Name 
[(7S)-3-(2-hydroxypropyl)-7-methyl-6,8-dioxoisochromen-7-yl] (2E,4E)-2-methyltetradeca-2,4-dienoate
Manual XrefsDatabases
9617648ChemSpider