EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:232368 - (+)-cymbodiacetal

Default Structure
ChEBI IDCHEBI:232368
ChEBI Name(+)-cymbodiacetal
Stars
Last Modified7 November 2024
SubmitterFlyBase
DownloadsMolfile
FormulaC20H30O4
Net Charge0
Average Mass334.456
Monoisotopic Mass334.21441
SMILES[H][C@@]1(C(=C)C)CC[C@]23CC[C@@]4(CC[C@@]([H])(C(=C)C)C[C@@]4(O)O2)O[C@]3(O)C1
InChIInChI=1S/C20H30O4/c1-13(2)15-5-7-17-9-10-18(23-19(17,21)11-15)8-6-16(14(3)4)12-20(18,22)24-17/h15-16,21-22H,1,3,5-12H2,2,4H3/t15-,16-,17-,18-,19-,20-/m1/s1
InChIKeyWNSFNRZOIJSTPM-BZIXAJQCSA-N
Species of MetaboliteComponentSourceComments
Cymbopogon citratus (ncbitaxon:66014) - PubMed (34869921)
ChEBI Ontology
Outgoing Relation(s)
(+)-cymbodiacetal (CHEBI:232368) is a organic molecular entity (CHEBI:50860)