CHEBI:151084 - Etoxeridine

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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 Etoxeridine
ChEBI ID CHEBI:151084
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C18H27NO4
Net Charge 0
Average Mass 321.417
Monoisotopic Mass 321.19401
InChI InChI=1S/C18H27NO4/c1-2-23-17(21)18(16-6-4-3-5-7-16)8-10-19(11-9-18)12-14-22-15-13-20/h3-7,20H,2,8-15H2,1H3
InChIKey KJTKYGFGPQSRRA-UHFFFAOYSA-N
SMILES O=C(OCC)C1(C2=CC=CC=C2)CCN(CCOCCO)CC1
Metabolite of Species Details
Escherichia coli (NCBI:txid562) Found in cell lysate (BTO:0004304). of strain Escherichia coli str. K-12 substr. DH10B [NCBITAXON:316385] See: MetaboLights Study
ChEBI Ontology
Outgoing Etoxeridine (CHEBI:151084) is a piperidines (CHEBI:26151)
IUPAC Name
ethyl 1-[2-(2-hydroxyethoxy)ethyl]-4-phenylpiperidine-4-carboxylate