3-naphthalen-2-yl-D-alanine (CHEBI:183401)

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ChEBI Name	3-naphthalen-2-yl-D-alanine

ChEBI ID	CHEBI:183401

ChEBI ASCII Name	3-naphthalen-2-yl-D-alanine

Definition	A 3-naphthalen-2-ylalanine that has D-confliguration.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

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Formula

C13H13NO2

Net Charge

Average Mass

215.252

Monoisotopic Mass

215.09463

InChI

InChI=1S/C13H13NO2/c14-12(13(15)16)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7,12H,8,14H2,(H,15,16)/t12-/m1/s1

InChIKey

JPZXHKDZASGCLU-GFCCVEGCSA-N

SMILES

N[C@H](CC1=CC2=CC=CC=C2C=C1)C(O)=O

Metabolite of Species	Details
Bombus terrestris (NCBI:txid30195)	Found in brain (BTO:0000142). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195)	Found in hemolymph (BTO:0000572). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195)	Found in hindgut (BTO:0000510). See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	3-naphthalen-2-yl-D-alanine (CHEBI:183401) is a 3-naphthalen-2-ylalanine (CHEBI:229533) 3-naphthalen-2-yl-D-alanine (CHEBI:183401) is enantiomer of 3-naphthalen-2-yl-L-alanine (CHEBI:44170)

Incoming	3-naphthalen-2-yl-L-alanine (CHEBI:44170) is enantiomer of 3-naphthalen-2-yl-D-alanine (CHEBI:183401)

IUPAC Name

3-naphthalen-2-yl-D-alanine

Synonyms	Sources
(2R)-2-amino-3-(naphthalen-2-yl)propanoic acid	IUPAC
(2R)-2-amino-3-naphthalen-2-ylpropanoic acid	ChEBI
(αR)-α-amino-2-naphthalenepropanoic acid	ChEBI
(R)-2-amino-3-(naphthalen-2-yl)propanoic acid	ChEBI
3-(2-naphthyl)-D-alanine	ChEBI
β-2-naphthyl-D-alanine	ChEBI
D-3-(2-naphthyl)alanine	ChEBI
D-β-(2-naphthyl)alanine	ChEBI

Registry Number	Type	Source
76985-09-6	CAS Registry Number	ChEBI

Last Modified

02 February 2024