CHEBI:69913 - Euphodendrophane E, (rel)-

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Euphodendrophane E, (rel)-
ChEBI ID CHEBI:69913
Definition A natural product found in Euphorbia dendroides.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C38H50O12
Net Charge 0
Average Mass 698.79640
Monoisotopic Mass 698.33023
InChI InChI=1S/C38H50O12/c1-11-27(41)48-29-22(5)19-38(45)28(29)30(46-24(7)39)23(6)31(49-35(43)20(2)3)32(50-36(44)26-15-13-12-14-16-26)34(47-25(8)40)37(9,10)18-17-21(4)33(38)42/h12-18,20-22,28-32,34,45H,6,11,19H2,1-5,7-10H3/b18-17+/t21-,22+,28-,29+,30+,31+,32-,34-,38-/m1/s1
InChIKey AJDFLYUZLBJRGW-JGZNVUOESA-N
SMILES [H][C@]12[C@@H](OC(=O)CC)[C@@H](C)C[C@]1(O)C(=O)[C@H](C)\C=C\C(C)(C)[C@H](OC(C)=O)[C@H](OC(=O)c1ccccc1)[C@@H](OC(=O)C(C)C)C(=C)[C@@H]2OC(C)=O
Metabolite of Species Details
Euphorbia dendroides (NCBI:txid38845) Found in aerial part (BTO:0001658). 60% aqueous ethanol extract of Dried plant material 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 Euphodendrophane E, (rel)- (CHEBI:69913) has role metabolite (CHEBI:25212)
Euphodendrophane E, (rel)- (CHEBI:69913) is a diterpenoid (CHEBI:23849)
Citation Waiting for Citations Type Source
21707046 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:benzoate ester(CHEBI:36054); ISA:carbonyl compound(CHEBI:36586); ISA:benzyl ether(CHEBI:59859); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:tertiary alcohol(CHEBI:26878); ISA:organic hydroxy compound(CHEBI:33822); ISA:carboxylic ester(CHEBI:33308); ISA:ketone(CHEBI:17087); ISA:organonitrogen compound(CHEBI:35352); ISA:organic heterocyclic compound(CHEBI:24532); ISA:ether(CHEBI:25698);