indole

Chemical Formula:

C₈H₇N

Molecular Weight:

117.15 Daltons

Monoisotopic Mass:

117.0578492299 Daltons

SMILES:

C2(C=CC1(=C(C=CN1)C=2))

InChI:

1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H

InChIKey:

SIKJAQJRHWYJAI-UHFFFAOYSA-N

Synonyms

2,3-Benzopyrrole

Databases

MetaCyc: INDOLE

RefMet: Indole

BiGG: indole

HMDB: HMDB00738

DRUGBANK: DB04532

ChemSpider: 776

PubChem (CID): 798

ChEBI: 16881

KEGG: C00463

CAS: 120-72-9

Reactome: 216547

Seed: cpd00359

MetaNetX: MNXM377

PupChem (SID): 3747

CHEMBL: CHEMBL15844

KNApSAcK: C00001418

PDB-CCD: IND

3DMET: B01251

NIKKAJI: J2.920C