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CHEBI:184288 - 6,8a-dihydroxy-1,1,4a,6-tetramethyl-5-{[(2-oxo-2H-chromen-7-yl)oxy]methyl}-decahydronaphthalen-2-yl acetate

ChEBI IDCHEBI:184288
ChEBI Name6,8a-dihydroxy-1,1,4a,6-tetramethyl-5-{[(2-oxo-2H-chromen-7-yl)oxy]methyl}-decahydronaphthalen-2-yl acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H34O7
Net Charge0
Average Mass458.551
Monoisotopic Mass458.23045
SMILESCC(=O)OC1CCC2(C)C(COc3ccc4ccc(=O)oc4c3)C(C)(O)CCC2(O)C1(C)C
InChIInChI=1S/C26H34O7/c1-16(27)32-21-10-11-24(4)20(25(5,29)12-13-26(24,30)23(21,2)3)15-31-18-8-6-17-7-9-22(28)33-19(17)14-18/h6-9,14,20-21,29-30H,10-13,15H2,1-5H3
InChIKeyOVBXXWTXTXYHRR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) serum (BTO:0001239) MetaboLights (MTBLS3725)
ChEBI Ontology
Outgoing Relation(s)
6,8a-dihydroxy-1,1,4a,6-tetramethyl-5-{[(2-oxo-2H-chromen-7-yl)oxy]methyl}-decahydronaphthalen-2-yl acetate (CHEBI:184288) is a coumarins (CHEBI:23403)
IUPAC Name 
[6,8a-dihydroxy-1,1,4a,6-tetramethyl-5-[(2-oxochromen-7-yl)oxymethyl]-2,3,4,5,7,8-hexahydronaphthalen-2-yl] acetate
Manual XrefsDatabases
HMDB0134769HMDB