CHEBI:67444 - ananolignan G

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ChEBI Name ananolignan G
ChEBI ID CHEBI:67444
Definition A lignan with a dibenzocyclooctadiene skeleton isolated from Kadsura ananosma.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H34O10
Net Charge 0
Average Mass 530.56360
Monoisotopic Mass 530.21520
InChI InChI=1S/C28H34O10/c1-9-20(30)38-24-14(3)13(2)23(37-15(4)29)16-10-18(31-5)25(32-6)27(33-7)21(16)22-17(24)11-19-26(28(22)34-8)36-12-35-19/h10-11,13-14,23-24H,9,12H2,1-8H3/t13-,14+,23+,24+/m0/s1
InChIKey OHMVGFVPDINACF-XKEUNKRLSA-N
SMILES CCC(=O)O[C@@H]1[C@H](C)[C@H](C)[C@@H](OC(C)=O)c2cc(OC)c(OC)c(OC)c2-c2c1cc1OCOc1c2OC
Metabolite of Species Details
Kadsura ananosma (NCBI:txid133441) Found in seed (BTO:0001226). 70% aqueous acetone extract of air-dried and powdered seeds, biphenyl configuration is S See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing ananolignan G (CHEBI:67444) has role plant metabolite (CHEBI:76924)
ananolignan G (CHEBI:67444) is a acetate ester (CHEBI:47622)
ananolignan G (CHEBI:67444) is a aromatic ether (CHEBI:35618)
ananolignan G (CHEBI:67444) is a lignan (CHEBI:25036)
ananolignan G (CHEBI:67444) is a organic heterotetracyclic compound (CHEBI:38163)
ananolignan G (CHEBI:67444) is a oxacycle (CHEBI:38104)
ananolignan G (CHEBI:67444) is a propanoate ester (CHEBI:36243)
IUPAC Name
(5R,6S,7R,8R)-5-acetoxy-1,2,3,13-tetramethoxy-6,7-dimethyl-5,6,7,8-tetrahydrobenzo[3',4']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxol-8-yl propionate
Registry Number Type Source
21534263 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21381710 PubMed citation Europe PMC
Last Modified
09 January 2014