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CHEBI:67454 - Ananosin A

ChEBI IDCHEBI:67454
ChEBI NameAnanosin A
Stars
DefinitionA natural product found in Kadsura ananosma.
Last Modified28 February 2024
DownloadsMolfile
FormulaC28H34O9
Net Charge0
Average Mass514.571
Monoisotopic Mass514.22028
SMILESC/C=C(\C)C(=O)O[C@H]1c2cc(OC)c(OC)c(OC)c2-c2c(cc3c(c2OC)OCO3)[C@H](O)[C@H](C)[C@@H]1C
InChIInChI=1S/C28H34O9/c1-9-13(2)28(30)37-23-15(4)14(3)22(29)16-10-19-25(36-12-35-19)27(34-8)20(16)21-17(23)11-18(31-5)24(32-6)26(21)33-7/h9-11,14-15,22-23,29H,12H2,1-8H3/b13-9+/t14-,15+,22-,23-/m1/s1
InChIKeyYREZDJJVCCDBTG-INQFUDPWSA-N
Species of MetaboliteComponentSourceComments
Kadsura ananosma (ncbitaxon:133441) seed (BTO:0001226) PubMed (21381710) 70% aqueous acetone extract of air-dried and powdered seeds, biphenyl configuration is S
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Ananosin A (CHEBI:67454) has role metabolite (CHEBI:25212)
Ananosin A (CHEBI:67454) is a aromatic ether (CHEBI:35618)
Ananosin A (CHEBI:67454) is a organic heterotetracyclic compound (CHEBI:38163)
Ananosin A (CHEBI:67454) is a α,β-unsaturated carboxylic ester (CHEBI:51737)
Synonym  Source
2-butenoic acid, 2-methyl-, (5R,6S,7R,8R)-5,6,7,8-tetrahydro-8-hydroxy-1,2,3,13-tetramethoxy-6,7-dimethylbenzo[3',4']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxol-5-yl ester, (2E)-ChEBI
Manual XrefsDatabases
C00036723KNApSAcK
Citations