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CHEBI:200176 - Stachyline A

ChEBI IDCHEBI:200176
ChEBI NameStachyline A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H17NO3
Net Charge0
Average Mass235.283
Monoisotopic Mass235.12084
SMILESC=C(C)[C@H](O)COc1ccc(C/C=N/O)cc1
InChIInChI=1S/C13H17NO3/c1-10(2)13(15)9-17-12-5-3-11(4-6-12)7-8-14-16/h3-6,8,13,15-16H,1,7,9H2,2H3/b14-8+/t13-/m1/s1
InChIKeyRYDLTTLOGVZOMQ-SJWLEHQBSA-N
Species of MetaboliteComponentSourceComments
Stachylidium (ncbitaxon:796327) - PubMed (21162532)
ChEBI Ontology
Outgoing Relation(s)
Stachyline A (CHEBI:200176) is a aromatic ether (CHEBI:35618)
IUPAC Name 
(2S)-1-[4-[(2E)-2-hydroxyiminoethyl]phenoxy]-3-methylbut-3-en-2-ol
Manual XrefsDatabases
27026043ChemSpider