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CHEBI:180834 - 7-Acetoxy-6-hydroxylimonin

ChEBI IDCHEBI:180834
ChEBI Name7-Acetoxy-6-hydroxylimonin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H34O10
Net Charge0
Average Mass530.570
Monoisotopic Mass530.21520
SMILESCC(=O)OC1C(O)C2C(C)(C)OC3CC(=O)OCC32C2CCC3(C)C(c4ccoc4)OC(=O)C4OC43C12C
InChIInChI=1S/C28H34O10/c1-13(29)35-21-18(31)19-24(2,3)37-16-10-17(30)34-12-27(16,19)15-6-8-25(4)20(14-7-9-33-11-14)36-23(32)22-28(25,38-22)26(15,21)5/h7,9,11,15-16,18-22,31H,6,8,10,12H2,1-5H3
InChIKeyLFAMVZIOUNWBKU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) Article
ChEBI Ontology
Outgoing Relation(s)
7-Acetoxy-6-hydroxylimonin (CHEBI:180834) is a steroid lactone (CHEBI:26766)
IUPAC Name 
[19-(uran-3-yl)-11-hydroxy-9,9,13,20-tetramethyl-5,17-dioxo-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docosan-12-yl] acetate
Manual XrefsDatabases
HMDB0032834HMDB
35013500ChemSpider