CHEBI:213889 - 4-(3-methyl-2-butenyl) oxy 1-phenyl acetic acid

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 4-(3-methyl-2-butenyl) oxy 1-phenyl acetic acid
ChEBI ID CHEBI:213889
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H16O3
Net Charge 0
Average Mass 220.268
Monoisotopic Mass 220.10994
InChI InChI=1S/C13H16O3/c1-10(2)7-8-16-12-5-3-11(4-6-12)9-13(14)15/h3-7H,8-9H2,1-2H3,(H,14,15)
InChIKey YFTIKQOPFVOWHB-UHFFFAOYSA-N
SMILES O=C(O)CC1=CC=C(OCC=C(C)C)C=C1
Metabolite of Species Details
Aspergillus (NCBI:txid5052) See: PubMed
ChEBI Ontology
Outgoing 4-(3-methyl-2-butenyl) oxy 1-phenyl acetic acid (CHEBI:213889) is a aromatic ether (CHEBI:35618)
IUPAC Name
2-[4-(3-methylbut-2-enoxy)phenyl]acetic acid
Manual Xref Database
24312458 ChemSpider
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