CHEBI:66832 - Ejap-2

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ChEBI Name Ejap-2
ChEBI ID CHEBI:66832
Definition A natural product found in Celastrus orbiculatus and Euonymus japonicus.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C28H36O9
Net Charge 0
Average Mass 516.58000
Monoisotopic Mass 516.23593
InChI InChI=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
InChIKey ZFUSDYXRBKYLMJ-WCHYYCAUSA-N
SMILES [H][C@]12C[C@H](OC(=O)c3ccccc3)[C@]3(COC(C)=O)[C@H](CC[C@@H](C)[C@@]3(OC1(C)C)[C@@H]2OC(C)=O)OC(C)=O
Metabolite of Species Details
Euonymus japonicus (NCBI:txid212708) See: DOI
Celastrus orbiculatus (NCBI:txid85181) Found in root (BTO:0001188). See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Ejap-2 (CHEBI:66832) has role metabolite (CHEBI:25212)
Ejap-2 (CHEBI:66832) is a sesquiterpenoid (CHEBI:26658)
Synonyms Sources
(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 benzoate ChEBI
1beta-6alpha-15-triacetoxy-9alpha-benzoyloxy-dihydro-beta-agarofuran ChEBI
Citation Waiting for Citations Type Source
10346948 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:benzoate ester(CHEBI:36054); ISA:benzyl ether(CHEBI:59859); ISA:carbonyl compound(CHEBI:36586); ISA:oxacycle(CHEBI:38104); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:oxolanes(CHEBI:26912); ISA:carboxylic ester(CHEBI:33308); ISA:ether(CHEBI:25698); ISA:monocarboxylic acid(CHEBI:25384); ISA:organonitrogen compound(CHEBI:35352);