Met005826: 7-Chloro-L-tryptophan
Metabolite Information
Name
7-Chloro-L-tryptophan
IUPAC Name
(2S)-2-amino-3-(7-chloro-1H-indol-3-yl)propanoic acid
Molecular Formula
C11H11ClN2O2
Molecular Weight
238.67
Exact Mass
238.0509053
SMILES
C1=CC2=C(C(=C1)Cl)NC=C2CC(C(=O)O)N
InChIKey
DMQFGLHRDFQKNR-VIFPVBQESA-N
InChI
InChI=1S/C11H11ClN2O2/c12-8-3-1-2-7-6(5-14-10(7)8)4-9(13)11(15)16/h1-3,5,9,14H,4,13H2,(H,15,16)/t9-/m0/s1
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Organoheterocyclic compounds
Class:
Indoles and derivatives
Subclass:
Indolyl carboxylic acids and derivatives
Crops containing this metabolite
parsley
pea
pea
Metabolite Spectrum Accession Label