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CHEBI:69911 - Euphodendrophane C, (rel)-

ChEBI IDCHEBI:69911
ChEBI NameEuphodendrophane C, (rel)-
Stars
DefinitionA natural product found in Euphorbia dendroides.
Last Modified22 September 2014
DownloadsMolfile
FormulaC39H51NO13
Net Charge0
Average Mass741.831
Monoisotopic Mass741.33604
SMILES[H][C@@]12[C@@H](OC(C)=O)C(=C)[C@H](OC(=O)C(C)C)[C@@H](OC(C)=O)[C@@H](OC(=O)c3cccnc3)C(C)(C)/C=C/[C@@H](C)C(=O)[C@@]1(OC(C)=O)C[C@H](C)[C@@H]2OC(=O)CC
InChIInChI=1S/C39H51NO13/c1-12-28(44)50-30-22(5)18-39(53-26(9)43)29(30)31(48-24(7)41)23(6)32(51-36(46)20(2)3)33(49-25(8)42)35(38(10,11)16-15-21(4)34(39)45)52-37(47)27-14-13-17-40-19-27/h13-17,19-22,29-33,35H,6,12,18H2,1-5,7-11H3/b16-15+/t21-,22+,29-,30+,31+,32+,33-,35-,39-/m1/s1
InChIKeyBLAMKSWQPNRXKD-GXOYQKERSA-N
Species of MetaboliteComponentSourceComments
Euphorbia dendroides (ncbitaxon:38845) aerial part (BTO:0001658) PubMed (21707046) 60% aqueous ethanol extract of Dried plant material
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)
Euphodendrophane C, (rel)- (CHEBI:69911) has role metabolite (CHEBI:25212)
Euphodendrophane C, (rel)- (CHEBI:69911) is a diterpenoid (CHEBI:23849)
Citations