D-Alanyl-D-alanine

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Systematic / IUPAC Name: 2-(2-Aminopropanoylamino)propanoic acid

ID: Reference375

Other Names: (R)-2-((R)-2-Aminopropanamido)propanoic acid;
D-Ala-D-Ala;
D-Alanine, D-alanyl-

Formula: C6H12N2O3

Class: Endogenous Metabolites

Spectral Data

D-Alanyl-D-alanine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 154
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 1/9/2015 1:21:25 PM
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Identificators

InChI InChI=1S/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)/t3-,4-/m1/s1
InChI Key DEFJQIDDEAULHB-QWWZWVQMSA-N
Canonical SMILES CC(C(=O)NC(C)C(=O)O)N
CAS 2867201
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Other Names (R)-2-((R)-2-Aminopropanamido)propanoic acid;
D-Ala-D-Ala;
D-Alanine, D-alanyl-

In Other Databases

ChemSpider 4573916
ChEMBL CHEMBL299420
ChEBI CHEBI:16576; CHEBI:57822
KEGG C00993
HMDb HMDB03459
PubChem 5460362