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CHEBI:69313 - tsangibeilin A, rac-

ChEBI IDCHEBI:69313
ChEBI Nametsangibeilin A, rac-
Stars
DefinitionA natural product found in Beilschmiedia tsangii.
Last Modified22 September 2014
DownloadsMolfile
FormulaC24H26O4
Net Charge0
Average Mass378.468
Monoisotopic Mass378.18311
SMILES[H][C@@]12[C@@]3([H])[C@@]4([H])C[C@@]1([H])C=C[C@@H](C(=O)O)[C@]2([H])C=C[C@]3([H])[C@H]4CCCc1ccc2c(c1)OCO2
InChIInChI=1S/C24H26O4/c25-24(26)18-6-5-14-11-19-15(16-7-8-17(18)22(14)23(16)19)3-1-2-13-4-9-20-21(10-13)28-12-27-20/h4-10,14-19,22-23H,1-3,11-12H2,(H,25,26)/t14-,15-,16-,17+,18-,19+,22-,23-/m1/s1
InChIKeySSXKICOQNGDABW-UILCEBSMSA-N
Species of MetaboliteComponentSourceComments
Beilschmiedia tsangii (IPNI:462970-1) root (BTO:0001188) PubMed (21846089) Cold MeOH extract of dry and sliced roots
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)
tsangibeilin A, rac- (CHEBI:69313) has role metabolite (CHEBI:25212)
tsangibeilin A, rac- (CHEBI:69313) is a benzodioxoles (CHEBI:38298)
Synonym  Source
rel-(1S,1aS,2aS,5R,5aR,7aR,7bS,7cS)-1-[3-(1,3-Benzodioxol-5-yl)propyl]-1a,2,2a,5,5a,7a,7b,7c-octahydro-1H-cyclobuta[bc]acenaphthylene-5-carboxylic acidChEBI
Citations