Ethyl 3(R)-acetamido-3-(4-hydroxyphenyl)propanoate (CHEBI:214576)

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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 3(R)-acetamido-3-(4-hydroxyphenyl)propanoate

ChEBI ID	CHEBI:214576

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

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Formula

C13H17NO4

Net Charge

Average Mass

251.282

Monoisotopic Mass

251.11576

InChI

InChI=1S/C13H17NO4/c1-3-18-13(17)8-12(14-9(2)15)10-4-6-11(16)7-5-10/h4-7,12,16H,3,8H2,1-2H3,(H,14,15)/t12-/m1/s1

InChIKey

LJNDMODRTICCRB-GFCCVEGCSA-N

SMILES

O=C(OCC)C[C@@H](NC(=O)C)C1=CC=C(O)C=C1

Metabolite of Species	Details
Penicillium (NCBI:txid5073)	See: DOI

ChEBI Ontology
Outgoing	Ethyl 3(R)-acetamido-3-(4-hydroxyphenyl)propanoate (CHEBI:214576) has functional parent β-amino acid (CHEBI:33706) Ethyl 3(R)-acetamido-3-(4-hydroxyphenyl)propanoate (CHEBI:214576) is a organonitrogen compound (CHEBI:35352) Ethyl 3(R)-acetamido-3-(4-hydroxyphenyl)propanoate (CHEBI:214576) is a organooxygen compound (CHEBI:36963)

IUPAC Name

ethyl (3R)-3-acetamido-3-(4-hydroxyphenyl)propanoate