CHEBI:66435 - schweinfurthin E

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ChEBI Name schweinfurthin E
ChEBI ID CHEBI:66435
Definition A stilbenoid that is the 5-O-methyl ether derivative of vedelianin. Isolated from Macaranga alnifolia, it exhibits cytotoxic activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C30H38O6
Net Charge 0
Average Mass 494.61910
Monoisotopic Mass 494.26684
InChI InChI=1S/C30H38O6/c1-17(2)7-10-21-22(31)12-19(13-23(21)32)9-8-18-11-20-15-26-29(3,4)28(34)24(33)16-30(26,5)36-27(20)25(14-18)35-6/h7-9,11-14,24,26,28,31-34H,10,15-16H2,1-6H3/b9-8+/t24-,26-,28-,30-/m1/s1
InChIKey IYHZCJNEODJYKB-DMCZWXATSA-N
SMILES [H][C@]12Cc3cc(\C=C\c4cc(O)c(CC=C(C)C)c(O)c4)cc(OC)c3O[C@]1(C)C[C@@H](O)[C@@H](O)C2(C)C
Metabolite of Species Details
Macaranga alnifolia (NCBI:txid396448) Found in fruit (BTO:0000486). 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 schweinfurthin E (CHEBI:66435) has functional parent vedelianin (CHEBI:66352)
schweinfurthin E (CHEBI:66435) has role metabolite (CHEBI:25212)
schweinfurthin E (CHEBI:66435) is a cyclic ether (CHEBI:37407)
schweinfurthin E (CHEBI:66435) is a organic heterotricyclic compound (CHEBI:26979)
schweinfurthin E (CHEBI:66435) is a resorcinols (CHEBI:33572)
schweinfurthin E (CHEBI:66435) is a stilbenoid (CHEBI:26776)
IUPAC Name
(2S,3R,4aR,9aR)-7-{(E)-2-[3,5-dihydroxy-4-(3-methylbut-2-en-1-yl)phenyl]ethenyl}-5-methoxy-1,1,4a-trimethyl-2,3,4,4a,9,9a-hexahydro-1H-xanthene-2,3-diol
Synonym Source
5-O-methylvedelianin ChEBI
Registry Number Type Source
11042129 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
17326683 PubMed citation Europe PMC
19697910 PubMed citation Europe PMC
Last Modified
26 April 2013