CHEBI:200176 - Stachyline A

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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 Stachyline A
ChEBI ID CHEBI:200176
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H17NO3
Net Charge 0
Average Mass 235.283
Monoisotopic Mass 235.12084
InChI InChI=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
InChIKey RYDLTTLOGVZOMQ-SJWLEHQBSA-N
SMILES O(C1=CC=C(C/C=N/O)C=C1)C[C@@H](O)C(=C)C
Metabolite of Species Details
Stachylidium (NCBI:txid796327) See: PubMed
ChEBI Ontology
Outgoing 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 Xref Database
27026043 ChemSpider
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