melatonin
Chemical Formula:
C13H16N2O2
Molecular Weight:
232.282 Daltons
Monoisotopic Mass:
232.1211777682 Daltons
SMILES:
CC(=O)NCCC2(=CNC1(=C(C=C(OC)C=C1)2))
InChI:
1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)
InChIKey:
Synonyms
- N-acetyl-5-methoxy-tryptamine
- N-[2-(5-methoxyindol-3-yl)ethyl]acetamide
- 5-methoxy-N-acetyltryptamine
Databases
MetaCyc:
N-ACETYL-5-METHOXY-TRYPTAMINE
RefMet:
Melatonin
MetaboLights:
MTBLC16796
HMDB:
HMDB01389
DRUGBANK:
DB01065
ChemSpider:
872
PubChem (CID):
896
KEGG:
C01598
ChEBI:
16796
CAS:
73-31-4
Reactome:
209934
Seed:
cpd01124
MetaNetX:
MNXM1114