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CHEBI:69716 - Euphorbiaproliferin E

ChEBI IDCHEBI:69716
ChEBI NameEuphorbiaproliferin E
Stars
DefinitionA natural product found in Euphorbia prolifera.
Last Modified22 September 2014
DownloadsMolfile
FormulaC40H44O13
Net Charge0
Average Mass732.779
Monoisotopic Mass732.27819
SMILES[H][C@@]12[C@@H](OC(C)=O)[C@@]34CO[C@@](C)([C@H](OC(=O)c5ccccc5)[C@@]1(O)C[C@H](C)[C@@H]2OC(C)=O)[C@]3([H])[C@]1([H])[C@@]([H])(C[C@]1(C)OC(C)=O)[C@@H](OC(=O)c1ccccc1)C4=O
InChIInChI=1S/C40H44O13/c1-20-17-40(47)28(29(20)49-21(2)41)33(50-22(3)42)39-19-48-38(6,36(40)52-35(46)25-15-11-8-12-16-25)31(39)27-26(18-37(27,5)53-23(4)43)30(32(39)44)51-34(45)24-13-9-7-10-14-24/h7-16,20,26-31,33,36,47H,17-19H2,1-6H3/t20-,26+,27-,28+,29-,30+,31-,33+,36-,37-,38+,39-,40+/m0/s1
InChIKeyXUCRDWQKBZSMQZ-KWSBIESESA-N
Species of MetaboliteComponentSourceComments
Euphorbia prolifera (IPNI:347888-1) root (BTO:0001188) PubMed (21928782) Ethyl acetate soluble part of methanol extract of air-dried roots.
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)
Euphorbiaproliferin E (CHEBI:69716) has role metabolite (CHEBI:25212)
Euphorbiaproliferin E (CHEBI:69716) is a benzoate ester (CHEBI:36054)
Synonym  Source
3beta,5alpha,10beta-tri-O-acetyl-8beta,14beta-di-O-benzoylcyclomyrsinolChEBI
Citations