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CHEBI:191639 - Furanojaponin

ChEBI IDCHEBI:191639
ChEBI NameFuranojaponin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H28O3
Net Charge0
Average Mass316.441
Monoisotopic Mass316.20384
SMILES[H][C@@]12Cc3occ(C)c3C[C@]1(C)[C@@H](C)C[C@@H](OC(=O)/C(C)=C\C)C2
InChIInChI=1S/C20H28O3/c1-6-12(2)19(21)23-16-7-14(4)20(5)10-17-13(3)11-22-18(17)9-15(20)8-16/h6,11,14-16H,7-10H2,1-5H3/b12-6-/t14-,15+,16+,20+/m0/s1
InChIKeyDDJITDJHDCLHOK-VAHIDXFOSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
seed (BTO:0001226) MetaboLights (MTBLS4572)
bark (BTO:0001301) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
Furanojaponin (CHEBI:191639) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(4aR,5S,7R,8aR)-3,4a,5-trimethyl-5,6,7,8,8a,9-hexahydro-4H-benzo[][1]benzouran-7-yl] (Z)-2-methylbut-2-enoate
Manual XrefsDatabases
4476298ChemSpider