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CHEBI:66832 - Ejap-2

Default Structure
ChEBI IDCHEBI:66832
ChEBI NameEjap-2
Stars
DefinitionA natural product found in Celastrus orbiculatus and Euonymus japonicus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC28H36O9
Net Charge0
Average Mass516.587
Monoisotopic Mass516.23593
SMILES[H][C@]12C[C@H](OC(=O)c3ccccc3)[C@]3(COC(C)=O)[C@@H](OC(C)=O)CC[C@@H](C)[C@@]3(OC1(C)C)[C@@H]2OC(C)=O
InChIInChI=1S/C28H36O9/c1-16-12-13-22(34-18(3)30)27(15-33-17(2)29)23(36-25(32)20-10-8-7-9-11-20)14-21-24(35-19(4)31)28(16,27)37-26(21,5)6/h7-11,16,21-24H,12-15H2,1-6H3/t16-,21-,22+,23+,24-,27+,28-/m1/s1
InChIKeyZFUSDYXRBKYLMJ-WCHYYCAUSA-N
Species of MetaboliteComponentSourceComments
Celastrus orbiculatus (ncbitaxon:85181) root (BTO:0001188) PubMed (10346948)
Euonymus japonicus (ncbitaxon:212708) - DOI (10.1039/P19890001079)
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Ejap-2 (CHEBI:66832) has role metabolite (CHEBI:25212)
Ejap-2 (CHEBI:66832) is a sesquiterpenoid (CHEBI:26658)
Synonyms  Source
1beta-6alpha-15-triacetoxy-9alpha-benzoyloxy-dihydro-beta-agarofuranChEBI
(1S,2R,5S,6S,7S,9R,12R)-5,12-Diacetoxy-6-(acetoxymethyl)-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodec-7-yl benzoateChEBI
Citations