CHEBI:168527 - Benzyl glycinate

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ChEBI Name Benzyl glycinate
ChEBI ID CHEBI:168527
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information eMolecules:534594
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Formula C9H11NO2
Net Charge 0
Average Mass 165.192
Monoisotopic Mass 165.07898
InChI InChI=1S/C9H11NO2/c10-6-9(11)12-7-8-4-2-1-3-5-8/h1-5H,6-7,10H2
InChIKey JXYACYYPACQCDM-UHFFFAOYSA-N
SMILES O(CC1=CC=CC=C1)C(=O)CN
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
ChEBI Ontology
Outgoing Benzyl glycinate (CHEBI:168527) is a α-amino acid ester (CHEBI:46874)
IUPAC Name
benzyl 2-aminoacetate
Manual Xrefs Databases
362041 ChemSpider
HMDB0059934 HMDB
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Registry Number Type Source
1738-68-7 CAS Registry Number ChemIDplus