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CHEBI:175900 - Oleanderolide 3-acetate

Default Structure
ChEBI IDCHEBI:175900
ChEBI NameOleanderolide 3-acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H50O5
Net Charge0
Average Mass514.747
Monoisotopic Mass514.36582
SMILESCC(=O)OC1CCC2(C)C(CCC3(C)C2CC(O)C24OC(=O)C5(CCC(C)(C)CC52)CCC34C)C1(C)C
InChIInChI=1S/C32H50O5/c1-19(33)36-24-10-11-28(6)20(27(24,4)5)9-12-29(7)21(28)17-23(34)32-22-18-26(2,3)13-15-31(22,25(35)37-32)16-14-30(29,32)8/h20-24,34H,9-18H2,1-8H3
InChIKeySFSFDBPTPLSWRM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Oleanderolide 3-acetate (CHEBI:175900) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(16-hydroxy-4,5,9,9,13,20,20-heptamethyl-23-oxo-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl) acetate
Manual XrefsDatabases
35013758ChemSpider
HMDB0034647HMDB