CHEBI:233448 - 3,4-dehydrobrevicomin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 3,4-dehydrobrevicomin
ChEBI ID CHEBI:233448
Stars This entity has been manually annotated by a third party.
Submitter FlyBase
Supplier Information ChemicalBook:CB23152557, eMolecules:2720067, ZINC000000062796
Download Molfile XML SDF
Formula C9H14O2
Net Charge 0
Average Mass 154.209
Monoisotopic Mass 154.09938
InChI InChI=1S/C9H14O2/c1-3-7-8-5-4-6-9(2,10-7)11-8/h4,6-8H,3,5H2,1-2H3
InChIKey OTGRTVQRUOULGI-UHFFFAOYSA-N
SMILES O1C2CC=CC1(OC2CC)C
Metabolite of Species Details
Lactobacillus plantarum (NCBI:txid1590) See: PubMed
ChEBI Ontology
Outgoing 3,4-dehydrobrevicomin (CHEBI:233448) is a organic molecular entity (CHEBI:50860)
IUPAC Name
7-ethyl-5-methyl-6,8-dioxabicyclo[3.2.1]oct-3-ene
Registry Number Type Source
62255-25-8 CAS Registry Number SUBMITTER
Citation Waiting for Citations Type Source
31673827 PubMed citation SUBMITTER