CHEBI:65883 - Euphorbia diterpenoid 1

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ChEBI Name Euphorbia diterpenoid 1
ChEBI ID CHEBI:65883
ChEBI ASCII Name Euphorbia diterpenoid 1
Definition A tetracyclic diterpenoid isolated from the whole plant of Euphorbia decipiens and exhibits inhibitory activity against prolyl endopeptidase (EC 3.4.21.26).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C35H44O11
Net Charge 0
Average Mass 640.71730
Monoisotopic Mass 640.28836
InChI InChI=1S/C35H44O11/c1-8-12-26(38)44-28-20(4)17-34(46-22(6)37)27(28)30(45-31(39)23-13-10-9-11-14-23)33-18-42-35(34,41)32(7,40)29(33)24(19(2)3)15-16-25(33)43-21(5)36/h9-11,13-16,20,24-25,27-30,40-41H,2,8,12,17-18H2,1,3-7H3/t20-,24+,25+,27+,28-,29-,30+,32-,33+,34+,35+/m0/s1
InChIKey PGAJUQOMDBGDPH-BYYJYFEHSA-N
SMILES [H][C@]12[C@@H](OC(=O)CCC)[C@@H](C)C[C@]1(OC(C)=O)[C@]1(O)OC[C@]3([C@H](OC(C)=O)C=C[C@H](C(C)=C)[C@@]3([H])[C@]1(C)O)[C@@H]2OC(=O)c1ccccc1
Metabolite of Species Details
Euphorbia decipiens (NCBI:txid1031519) Found in whole plant (BTO:0001461). Air-dried ground plants 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.
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor
Any EC 3.4.21.* (serine endopeptidase) inhibitor that interferes with the action of prolyl oligopeptidase (EC 3.4.21.26).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Euphorbia diterpenoid 1 (CHEBI:65883) has role EC 3.4.21.26 (prolyl oligopeptidase) inhibitor (CHEBI:76779)
Euphorbia diterpenoid 1 (CHEBI:65883) has role metabolite (CHEBI:25212)
Euphorbia diterpenoid 1 (CHEBI:65883) is a acetate ester (CHEBI:47622)
Euphorbia diterpenoid 1 (CHEBI:65883) is a benzoate ester (CHEBI:36054)
Euphorbia diterpenoid 1 (CHEBI:65883) is a bridged compound (CHEBI:35990)
Euphorbia diterpenoid 1 (CHEBI:65883) is a butyrate ester (CHEBI:50477)
Euphorbia diterpenoid 1 (CHEBI:65883) is a cyclic ether (CHEBI:37407)
Euphorbia diterpenoid 1 (CHEBI:65883) is a lactol (CHEBI:38131)
Euphorbia diterpenoid 1 (CHEBI:65883) is a tetracyclic diterpenoid (CHEBI:52557)
IUPAC Name
(2S,3S,3aR,4R,4aR,5R,8S,8aR,9S,10R,10aR)-5,10a-bis(acetyloxy)-3-(butanoyloxy)-9,10-dihydroxy-2,9-dimethyl-8-(prop-1-en-2-yl)-2,3,3a,4,5,8,8a,9,10,10a-decahydro-1H-10,4a-(epoxymethano)benzo[f]azulen-4-yl benzoate
Registry Number Type Source
9461711 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
12808253 PubMed citation Europe PMC
Last Modified
23 December 2013