CHEBI:182083 - 3,4,12,13,15,16-Hexahydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-6-en-11-one

ChEBI IDCHEBI:182083
ChEBI Name3,4,12,13,15,16-Hexahydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-6-en-11-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O8
Net Charge0
Average Mass398.452
Monoisotopic Mass398.19407
SMILESCC1=C2CC3OC(=O)C(O)C4(O)C(C)C(O)C(O)C(C2(C)C(O)C(O)C1)C34C
InChIInChI=1S/C20H30O8/c1-7-5-10(21)15(24)18(3)9(7)6-11-19(4)14(18)13(23)12(22)8(2)20(19,27)16(25)17(26)28-11/h8,10-16,21-25,27H,5-6H2,1-4H3
InChIKeyKHGBORGCCDJDRD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3,4,12,13,15,16-Hexahydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-6-en-11-one (CHEBI:182083) is a quassinoid (CHEBI:72485)
IUPAC Name 
3,4,12,13,15,16-hexahydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-6-en-11-one