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CHEBI:229844 - 4-o-methyl-3',4'-methylenedioxymopanan-4alpha-ol

ChEBI IDCHEBI:229844
ChEBI Name4-o-methyl-3',4'-methylenedioxymopanan-4alpha-ol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H16O6
Net Charge0
Average Mass328.320
Monoisotopic Mass328.09469
SMILESCO[C@@H]1c2ccc(O)cc2O[C@@H]2c3ccc4c(c3CO[C@@H]12)OCO4
InChIInChI=1S/C18H16O6/c1-20-16-11-3-2-9(19)6-14(11)24-17-10-4-5-13-15(23-8-22-13)12(10)7-21-18(16)17/h2-6,16-19H,7-8H2,1H3/t16-,17-,18+/m1/s1
InChIKeyUCGKJWSJSJGUBQ-KURKYZTESA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
4-o-methyl-3',4'-methylenedioxymopanan-4alpha-ol (CHEBI:229844) is a extended flavonoid (CHEBI:71037)
IUPAC Name 
(1R,13S,14R)-14-methoxy-6,8,12,21-tetraoxapentacyclo[11.8.0.02,10.05,9.015,20]henicosa-2(10),3,5(9),15(20),16,18-hexaen-18-ol
Manual XrefsDatabases
24842636ChemSpider
LMPK12020226LIPID MAPS