N-Acetyl-L-tryptophan

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Systematic / IUPAC Name: (2S)-2-Acetamido-3-(1H-indol-3-yl)propanoic acid

ID: Reference13763

Other Names: N-Acetyl-Trp-OH;
AA-3549

Formula: C13H14N2O3

Class: Endogenous Metabolites

Spectral Data

N-Acetyl-L-tryptophan 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 ID-X with ETD_Cal Gateshead
No. of Spectral Trees 1
No. of Spectra 3297
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 1/28/2026 12:00:04 PM
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Identificators

InChI InChI=1S/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/t12-/m0/s1
InChI Key DZTHIGRZJZPRDV-LBPRGKRZSA-N
Canonical SMILES CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
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Other Names N-Acetyl-Trp-OH;
AA-3549

In Other Databases

PubChem 700653
HMDb HMDB13713
ChEMBL CHEMBL54170
ChemSpider More details; 610602
ChEBI CHEBI:74640