CHEBI:210086 - (2'R)-westerdijkin A

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 (2'R)-westerdijkin A
ChEBI ID CHEBI:210086
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H18O4
Net Charge 0
Average Mass 250.294
Monoisotopic Mass 250.12051
InChI InChI=1S/C14H18O4/c1-10(2)13(15)9-18-12-6-4-11(5-7-12)8-14(16)17-3/h4-7,13,15H,1,8-9H2,2-3H3/t13-/m0/s1
InChIKey PYYHOQKLLMMOGK-ZDUSSCGKSA-N
SMILES O=C(OC)CC1=CC=C(OC[C@H](O)C(=C)C)C=C1
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing (2'R)-westerdijkin A (CHEBI:210086) is a aromatic ether (CHEBI:35618)
IUPAC Name
methyl 2-[4-[(2R)-2-hydroxy-3-methylbut-3-enoxy]phenyl]acetate
Manual Xref Database
83986150 ChemSpider
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