santacruzamate A (CHEBI:188612)

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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	santacruzamate A

ChEBI ID	CHEBI:188612

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H22N2O3

Net Charge

Average Mass

278.352

Monoisotopic Mass

278.16304

InChI

InChI=1S/C15H22N2O3/c1-2-20-15(19)17-11-6-9-14(18)16-12-10-13-7-4-3-5-8-13/h3-5,7-8H,2,6,9-12H2,1H3,(H,16,18)(H,17,19)

InChIKey

HTOYBIILVCHURC-UHFFFAOYSA-N

SMILES

O=C(NCCC1=CC=CC=C1)CCCNC(OCC)=O

Metabolite of Species	Details
Phyllostachys violascens (NCBI:txid1903417)	Found in stem (BTO:0001300). of strain Phyllostachys violascens cv. Viridisulcata See: MetaboLights Study

ChEBI Ontology
Outgoing	santacruzamate A (CHEBI:188612) has functional parent γ-amino acid (CHEBI:33707) santacruzamate A (CHEBI:188612) is a organonitrogen compound (CHEBI:35352) santacruzamate A (CHEBI:188612) is a organooxygen compound (CHEBI:36963)

IUPAC Name

ethyl N-[4-oxo-4-(2-phenylethylamino)butyl]carbamate