Met006397: N-palmitoyl phenylalanine
Metabolite Information
Name
N-palmitoyl phenylalanine
IUPAC Name
(2S)-2-(hexadecanoylamino)-3-phenylpropanoic acid
Molecular Formula
C25H41NO3
Molecular Weight
403.6
Exact Mass
403.3086442
SMILES
CCCCCCCCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)O
InChIKey
BAHIJPSQSKWCJX-QHCPKHFHSA-N
InChI
InChI=1S/C25H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-24(27)26-23(25(28)29)21-22-18-15-14-16-19-22/h14-16,18-19,23H,2-13,17,20-21H2,1H3,(H,26,27)(H,28,29)/t23-/m0/s1
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Organic acids and derivatives
Class:
Carboxylic acids and derivatives
Subclass:
Amino acids, peptides, and analogues
Crops containing this metabolite
adzuki_bean
avocado
cowpea
mung_bean
peanut
avocado
cowpea
mung_bean
peanut
Metabolite Spectrum Accession Label