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CHEBI:199623 - Cochliodone G

ChEBI IDCHEBI:199623
ChEBI NameCochliodone G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H38O13
Net Charge0
Average Mass666.676
Monoisotopic Mass666.23124
SMILESCC(=O)O[C@@]1(C)C(=O)C2=COC(CCCC(C)O)=CC2=C(C2=C3C=C(CCCC(C)OC=O)OC=C3C(=O)[C@@](C)(OC(C)=O)C2=O)C1=O
InChIInChI=1S/C35H38O13/c1-18(37)9-7-11-22-13-24-26(15-44-22)30(40)34(5,47-20(3)38)32(42)28(24)29-25-14-23(12-8-10-19(2)46-17-36)45-16-27(25)31(41)35(6,33(29)43)48-21(4)39/h13-19,37H,7-12H2,1-6H3/t18?,19?,34-,35+/m0/s1
InChIKeyDFPZJXAFNKWLNU-HMHDNZLNSA-N
Species of MetaboliteComponentSourceComments
Chaetomium (ncbitaxon:5149) - DOI (10.1016/j.phytol.2016.05.003)
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)
Cochliodone G (CHEBI:199623) is a azaphilone (CHEBI:50941)
IUPAC Name 
[(7R)-5-[(7S)-7-acetyloxy-3-(4-ormyloxypentyl)-7-methyl-6,8-dioxoisochromen-5-yl]-3-(4-hydroxypentyl)-7-methyl-6,8-dioxoisochromen-7-yl] acetate
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78442276ChemSpider