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CHEBI:69713 - Euphorbiaproliferin B, (rel)-

ChEBI IDCHEBI:69713
ChEBI NameEuphorbiaproliferin B, (rel)-
Stars
DefinitionA natural product found in Euphorbia prolifera.
Last Modified26 August 2015
DownloadsMolfile
FormulaC46H54O15
Net Charge0
Average Mass846.923
Monoisotopic Mass846.34627
SMILES[H][C@@]12[C@@H](OC(C)=O)[C@@]34CO[C@@](C)([C@@H](OC(=O)c5ccccc5)[C@@]1(OC(C)=O)C[C@@](C)(OC(=O)c1ccccc1)[C@@H]2OC(=O)CCC)[C@]3([H])[C@@H](C(C)(C)OC(C)=O)C=C[C@H]4OC(C)=O
InChIInChI=1S/C46H54O15/c1-10-17-34(51)57-37-35-38(56-27(3)48)45-25-54-44(9,36(45)32(42(6,7)59-28(4)49)22-23-33(45)55-26(2)47)41(58-39(52)30-18-13-11-14-19-30)46(35,60-29(5)50)24-43(37,8)61-40(53)31-20-15-12-16-21-31/h11-16,18-23,32-33,35-38,41H,10,17,24-25H2,1-9H3/t32-,33+,35+,36-,37+,38+,41+,43+,44+,45+,46+/m0/s1
InChIKeyGLKWKFVTWFLQRO-NGGQJPHGSA-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 B, (rel)- (CHEBI:69713) has role metabolite (CHEBI:25212)
Euphorbiaproliferin B, (rel)- (CHEBI:69713) is a benzoate ester (CHEBI:36054)
Euphorbiaproliferin B, (rel)- (CHEBI:69713) is a butyrate ester (CHEBI:50477)
Synonym  Source
rel-2alpha,14alpha-di-O-benzoyl-3beta-O-butyryl-5alpha,7beta,10,15beta-tetra-O-acetyl-10,18-dihydromyrsinolChEBI
Citations