CHEBI:67449 - ananolignan L

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name ananolignan L
ChEBI ID CHEBI:67449
Definition A lignan with a dibenzocyclooctadiene skeleton isolated from Kadsura ananosma.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C30H36O10
Net Charge 0
Average Mass 556.60080
Monoisotopic Mass 556.23085
InChI InChI=1S/C30H36O10/c1-10-14(2)30(32)40-25-16(4)15(3)24(39-17(5)31)19-12-21-27(38-13-37-21)29(36-9)23(19)22-18(25)11-20(33-6)26(34-7)28(22)35-8/h10-12,15-16,24-25H,13H2,1-9H3/b14-10+/t15-,16+,24-,25-/m1/s1
InChIKey HIGLJZHMTBHEQS-ULEIZWEFSA-N
SMILES COc1cc2[C@H](OC(=O)C(\C)=C\C)[C@@H](C)[C@@H](C)[C@@H](OC(C)=O)c3cc4OCOc4c(OC)c3-c2c(OC)c1OC
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.
Application(s): neuroprotective agent
Any compound that can be used for the treatment of neurodegenerative disorders.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing ananolignan L (CHEBI:67449) has functional parent tiglic acid (CHEBI:9592)
ananolignan L (CHEBI:67449) has role neuroprotective agent (CHEBI:63726)
ananolignan L (CHEBI:67449) has role plant metabolite (CHEBI:76924)
ananolignan L (CHEBI:67449) is a acetate ester (CHEBI:47622)
ananolignan L (CHEBI:67449) is a aromatic ether (CHEBI:35618)
ananolignan L (CHEBI:67449) is a enoate ester (CHEBI:51702)
ananolignan L (CHEBI:67449) is a lignan (CHEBI:25036)
ananolignan L (CHEBI:67449) is a organic heterotetracyclic compound (CHEBI:38163)
ananolignan L (CHEBI:67449) is a oxacycle (CHEBI:38104)
IUPAC Name
(5R,6S,7R,8R)-8-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-5-yl (2E)-2-methylbut-2-enoate
Registry Number Type Source
21534267 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21381710 PubMed citation Europe PMC
Last Modified
09 January 2014