skatole
A methylindole carrying a methyl substituent at position 3. It is produced during the anoxic metabolism of L-tryptophan in the mammalian digestive tract.
Exact Synonyms
3-methyl-1H-indole
skatole
Skatole
Related Synonyms
3-methyl-4,5-benzopyrrole
3-Methylindole
beta-methylindole
Skatol
class Information
charge
0
formula
C9H9N
has_dbxref
- CAS:83-34-1
- Gmelin:396961
- HMDB:HMDB0000466
- KEGG:C08313
- KNApSAcK:C00001430
- LINCS:LSM-3655
- MetaCyc:SKATOLE
- PMID:16656260
- PMID:22950976
- PMID:24358366
- PMID:7487051
- Reaxys:111296
- Wikipedia:Skatole
has_obo_namespace
chebi_ontology
inchi
InChI=1S/C9H9N/c1-7-6-10-9-5-3-2-4-8(7)9/h2-6,10H,1H3
inchikey
ZFRKQXVRDFCRJG-UHFFFAOYSA-N
in_subset
mass
131.17450
monoisotopicmass
131.07350
smiles
Cc1c[nH]c2ccccc12
class Relations
Subclass of