CHEBI:65884 - Euphorbia diterpenoid 2

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ChEBI Name Euphorbia diterpenoid 2
ChEBI ID CHEBI:65884
ChEBI ASCII Name Euphorbia diterpenoid 2
Definition A tetracyclic diterpenoid isolated from the whole plant of Euphorbia decipiens and exhibits inhibitory activity against urease.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C32H39NO11
Net Charge 0
Average Mass 613.65220
Monoisotopic Mass 613.25231
InChI InChI=1S/C32H39NO11/c1-16(2)22-10-11-23(41-18(4)34)30-15-40-32(39,29(7,38)26(22)30)31(44-20(6)36)13-17(3)25(42-19(5)35)24(31)27(30)43-28(37)21-9-8-12-33-14-21/h8-12,14,17,22-27,38-39H,1,13,15H2,2-7H3/t17-,22+,23+,24+,25-,26-,27+,29-,30+,31+,32+/m0/s1
InChIKey JWNQQMAJTFWUKZ-PJWNUARVSA-N
SMILES [H][C@]12[C@@H](OC(C)=O)[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)c1cccnc1
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): EC 3.5.1.5 (urease) inhibitor
EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor that interferes with the activity of urease (EC 3.5.1.5), reducing hydrolysis.
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 Euphorbia diterpenoid 2 (CHEBI:65884) has functional parent nicotinic acid (CHEBI:15940)
Euphorbia diterpenoid 2 (CHEBI:65884) has role EC 3.5.1.5 (urease) inhibitor (CHEBI:50635)
Euphorbia diterpenoid 2 (CHEBI:65884) has role metabolite (CHEBI:25212)
Euphorbia diterpenoid 2 (CHEBI:65884) is a acetate ester (CHEBI:47622)
Euphorbia diterpenoid 2 (CHEBI:65884) is a bridged compound (CHEBI:35990)
Euphorbia diterpenoid 2 (CHEBI:65884) is a cyclic ether (CHEBI:37407)
Euphorbia diterpenoid 2 (CHEBI:65884) is a lactol (CHEBI:38131)
Euphorbia diterpenoid 2 (CHEBI:65884) is a tetracyclic diterpenoid (CHEBI:52557)
IUPAC Name
(2S,3S,3aR,4R,4aR,5R,8S,8aR,9S,10R,10aR)-3,5,10a-tris(acetyloxy)-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 pyridine-3-carboxylate
Registry Number Type Source
9460756 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
12808253 PubMed citation Europe PMC
Last Modified
23 January 2013