Met004312: Indole
Metabolite Information
Name
Indole
IUPAC Name
1H-indole
Molecular Formula
C8H7N
Molecular Weight
117.15
Exact Mass
117.0578492
SMILES
C1=CC=C2C(=C1)C=CN2
InChIKey
SIKJAQJRHWYJAI-UHFFFAOYSA-N
InChI
InChI=1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Organoheterocyclic compounds
Class:
Indoles and derivatives
Subclass:
Indoles
Crops containing this metabolite
astragalus
maize
medicago
sweet_potato
wheat
morus
s_miltiorrhiza
leonurus
maize
medicago
sweet_potato
wheat
morus
s_miltiorrhiza
leonurus
Metabolite Spectrum Accession Label