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Chemical structure of N-(3-Indolylacetyl)-L-alanine

GC65230

N-(3-Indolylacetyl)-L-alanine

Also known as (2S)-2-[[2-(1H-indol-3-yl)acetyl]amino]propanoic acid

N-(3-Indolylacetyl)-L-alanine (Indoleacetylalanine) is an indoleacetylamino acid

ChemicalCAS57105-39-2MW246.26FormulaC13H14N2O3
CAS number
57105-39-2
Molecular weight
246.26
Formula
C13H14N2O3
Solubility
DMSO ： 250 mg/mL (1015·19 mM; Need ultrasonic)
InChIKey
FBDCJLXTUCMFLF-QMMMGPOBSA-N
Catalogue number
GC65230
Brand
GLPBIO
Computed properties PubChem CID 644225 · XLogP 1.2 · TPSA 82.2 Ų · H-bond donors 3
XLogP
1.2
TPSA
82.2 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
18

SMILES C[C@@H](C(=O)O)NC(=O)CC1=CNC2=CC=CC=C21

Computed descriptors from PubChem (CID 644225), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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