EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:9276 - Stramonin B

ChEBI IDCHEBI:9276
ChEBI NameStramonin B
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H18O4
Net Charge0
Average Mass262.305
Monoisotopic Mass262.12051
SMILES[H][C@@]12CC[C@H](C)[C@]3([H])C=CC(=O)[C@@]3(C)[C@]1([H])OC(=O)[C@]21CO1
InChIInChI=1S/C15H18O4/c1-8-3-4-10-12(19-13(17)15(10)7-18-15)14(2)9(8)5-6-11(14)16/h5-6,8-10,12H,3-4,7H2,1-2H3/t8-,9-,10+,12+,14-,15-/m0/s1
InChIKeyAYSAVJUPCHRCGO-ODHINMQUSA-N
ChEBI Ontology
Outgoing Relation(s)
Stramonin B (CHEBI:9276) is a γ-lactone (CHEBI:37581)
Synonym  Source
Stramonin BKEGG COMPOUND
Manual XrefsDatabases
C09552KEGG COMPOUND
C00003369KNApSAcK
Registry NumbersSources
CAS:65179-88-6KEGG COMPOUND