Preferred Name

L-cis-Cyclo(aspartylphenylalanyl)

Synonyms

2-(5-benzyl-3,6-dioxopiperazin-2-yl)acetic acid

ID

http://purl.obolibrary.org/obo/CHEBI_168231

charge

0

database_cross_reference

Chemspider:106716

HMDB:HMDB0031360

CAS:55102-13-1

formula

C13H14N2O4

has functional parent

http://purl.obolibrary.org/obo/CHEBI_33704

has_exact_synonym

2-(5-benzyl-3,6-dioxopiperazin-2-yl)acetic acid

has_obo_namespace

chebi_ontology

id

CHEBI:168231

in_subset

http://purl.obolibrary.org/obo/chebi#2_STAR

inchi

InChI=1S/C13H14N2O4/c16-11(17)7-10-13(19)14-9(12(18)15-10)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,14,19)(H,15,18)(H,16,17)

inchikey

VNHJXYUDIBQDDX-UHFFFAOYSA-N

label

L-cis-Cyclo(aspartylphenylalanyl)

mass

262.265

monoisotopicmass

262.09536

notation

CHEBI:168231

prefLabel

L-cis-Cyclo(aspartylphenylalanyl)

smiles

O=C1NC(C(=O)NC1CC2=CC=CC=C2)CC(O)=O

treeView

http://purl.obolibrary.org/obo/CHEBI_35352

http://purl.obolibrary.org/obo/CHEBI_36963

subClassOf

http://purl.obolibrary.org/obo/CHEBI_35352

http://purl.obolibrary.org/obo/CHEBI_36963

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