CHEBI:143760 - ethyl 2-[4-(1-adamantyl)phenoxy]propanoate

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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 ethyl 2-[4-(1-adamantyl)phenoxy]propanoate
ChEBI ID CHEBI:143760
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C21H28O3
Net Charge 0
Average Mass 328.446
Monoisotopic Mass 328.204
InChI InChI=1S/C21H28O3/c1-3-23-20(22)14(2)24-19-6-4-18(5-7-19)21-11-15-8-16(12-21)10-17(9-15)13-21/h4-7,14-17H,3,8-13H2,1-2H3/t14-,15?,16?,17?,21?/m0/s1
InChIKey GXIWSIXBBVGHCQ-HILYYZTDSA-N
SMILES O=C(OCC)[C@@H](OC1=CC=C(C23CC4CC(C2)CC(C3)C4)C=C1)C
Metabolite of Species Details
Bathymodiolus (NCBI:txid12965) Found in gill filament {BTO:0002150 See: MetaboLights Study
ChEBI Ontology
Outgoing ethyl 2-[4-(1-adamantyl)phenoxy]propanoate (CHEBI:143760) is a carboxylic ester (CHEBI:33308)