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CHEBI:175242 - 16-Methyl-epi-nigakihemiacetal B

ChEBI IDCHEBI:175242
ChEBI Name16-Methyl-epi-nigakihemiacetal B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H32O6
Net Charge0
Average Mass404.503
Monoisotopic Mass404.21989
SMILESCOC1=CC(C)C2CC3OC(OC)CC4C(C)=C(OC)C(=O)C(C2(C)C1=O)C34C
InChIInChI=1S/C23H32O6/c1-11-8-15(26-5)21(25)23(4)13(11)9-16-22(3)14(10-17(27-6)29-16)12(2)19(28-7)18(24)20(22)23/h8,11,13-14,16-17,20H,9-10H2,1-7H3
InChIKeyMSXBIQMJEOYRDV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
16-Methyl-epi-nigakihemiacetal B (CHEBI:175242) is a quassinoid (CHEBI:72485)
IUPAC Name 
4,11,15-trimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,16-dione
Manual XrefsDatabases
35014891ChemSpider
HMDB0039886HMDB