EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:214683 - Minutellin C

ChEBI IDCHEBI:214683
ChEBI NameMinutellin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H28O6
Net Charge0
Average Mass448.515
Monoisotopic Mass448.18859
SMILESCCCCCCCC(=O)C1=C2C3=COC(c4c(C)cccc4O)=CC3=CC(=O)[C@]2(C)OC1=O
InChIInChI=1S/C27H28O6/c1-4-5-6-7-8-11-20(29)24-25-18-15-32-21(23-16(2)10-9-12-19(23)28)13-17(18)14-22(30)27(25,3)33-26(24)31/h9-10,12-15,28H,4-8,11H2,1-3H3/t27-/m0/s1
InChIKeyPLQYMOBYQVRZFP-MHZLTWQESA-N
Species of MetaboliteComponentSourceComments
Jackrogersella minutella (ncbitaxon:1955266) - PubMed (28215421)
ChEBI Ontology
Outgoing Relation(s)
Minutellin C (CHEBI:214683) is a polyketide (CHEBI:26188)
IUPAC Name 
(6aR)-3-(2-hydroxy-6-methylphenyl)-6a-methyl-9-octanoyluro[2,3-h]isochromene-6,8-dione
Manual XrefsDatabases
78443442ChemSpider