CHEBI:66161 - samaderine E

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ChEBI Name samaderine E
ChEBI ID CHEBI:66161
Definition A quassinoid isolated from Quassia indica and Samadera indica and has been shown to exhibit antimalarial and cytotoxic activities.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H26O8
Net Charge 0
Average Mass 394.41560
Monoisotopic Mass 394.16277
InChI InChI=1S/C20H26O8/c1-8-4-10(21)15(24)17(2)9(8)5-11-19-7-27-18(3,16(25)13(23)14(17)19)20(19,26)6-12(22)28-11/h4,9,11,13-16,23-26H,5-7H2,1-3H3/t9-,11+,13+,14+,15+,16-,17-,18+,19+,20+/m0/s1
InChIKey MGGPOESVKAWHRB-KZOVRTNRSA-N
SMILES [H][C@@]12C[C@@]3([H])C(C)=CC(=O)[C@@H](O)[C@]3(C)[C@@]3([H])[C@@H](O)[C@H](O)[C@@]4(C)OC[C@@]13[C@@]4(O)CC(=O)O2
Metabolite of Species Details
Samadera indica (NCBI:txid459147) See: DOI
Samadera indica (NCBI:txid459147) Found in stem (BTO:0001300). 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.
antimalarial
A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
Application(s): antimalarial
A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing samaderine E (CHEBI:66161) has role antimalarial (CHEBI:38068)
samaderine E (CHEBI:66161) has role antineoplastic agent (CHEBI:35610)
samaderine E (CHEBI:66161) has role metabolite (CHEBI:25212)
samaderine E (CHEBI:66161) is a δ-lactone (CHEBI:18946)
samaderine E (CHEBI:66161) is a cyclic ether (CHEBI:37407)
samaderine E (CHEBI:66161) is a enone (CHEBI:51689)
samaderine E (CHEBI:66161) is a organic heteropentacyclic compound (CHEBI:38164)
samaderine E (CHEBI:66161) is a quassinoid (CHEBI:72485)
samaderine E (CHEBI:66161) is a secondary α-hydroxy ketone (CHEBI:2468)
samaderine E (CHEBI:66161) is a secondary alcohol (CHEBI:35681)
samaderine E (CHEBI:66161) is a tertiary alcohol (CHEBI:26878)
samaderine E (CHEBI:66161) is a tetrol (CHEBI:33573)
IUPAC Name
(1β,11β,12α)-1,11,12,14-tetrahydroxy-13,20-epoxypicras-3-ene-2,16-dione
Registry Number Type Source
6668062 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
8945767 PubMed citation Europe PMC
Last Modified
06 February 2018