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CHEBI:175241 - 1alpha-O-Methylquassin

ChEBI IDCHEBI:175241
ChEBI Name1alpha-O-Methylquassin
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SubmitterMetaboLights
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FormulaC23H32O6
Net Charge0
Average Mass404.503
Monoisotopic Mass404.21989
SMILESCOC1=CC(C)C2CC3OC(=O)CC4C(C)=C(OC)C(=O)C(C34C)C2(C)C1OC
InChIInChI=1S/C23H32O6/c1-11-8-15(26-5)21(28-7)23(4)13(11)9-16-22(3)14(10-17(24)29-16)12(2)19(27-6)18(25)20(22)23/h8,11,13-14,16,20-21H,9-10H2,1-7H3
InChIKeyYHEQIRIWAKHQFI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1alpha-O-Methylquassin (CHEBI:175241) is a quassinoid (CHEBI:72485)
IUPAC Name 
3,4,15-trimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-11,16-dione
Manual XrefsDatabases
HMDB0039558HMDB
35014821ChemSpider