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CHEBI:216163 - Mollicellin Q

ChEBI IDCHEBI:216163
ChEBI NameMollicellin Q
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H26O7
Net Charge0
Average Mass414.454
Monoisotopic Mass414.16785
SMILESCCOCc1c(O)cc(C)c2c1Oc1cc3c(c(C)c1OC2=O)C[C@H](O)C(C)(C)O3
InChIInChI=1S/C23H26O7/c1-6-27-10-14-15(24)7-11(2)19-21(14)28-17-9-16-13(8-18(25)23(4,5)30-16)12(3)20(17)29-22(19)26/h7,9,18,24-25H,6,8,10H2,1-5H3/t18-/m0/s1
InChIKeyRCLMCNQLMYPAFZ-SFHVURJKSA-N
Species of MetaboliteComponentSourceComments
Chaetomium (ncbitaxon:5149) - PubMed (30563178)
ChEBI Ontology
Outgoing Relation(s)
Mollicellin Q (CHEBI:216163) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
11-(ethoxymethyl)-3,10-dihydroxy-2,2,5,8-tetramethyl-3,4-dihydrochromeno[7,6-b][1,4]benzodioxepin-7-one