2-Iodomelatonin

COC1=CC=C2NC(I)=C(CCNC(C)=O)C2=C1

InChIKey=FJDDSMSDZHURBJ-UHFFFAOYSA-N

InChI=1S/C13H15IN2O2/c1-8(17)15-6-5-10-11-7-9(18-2)3-4-12(11)16-13(10)14/h3-4,7,16H,5-6H2,1-2H3,(H,15,17)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Targets

Primary Target	Pharmacology	Condition	Potency
Melatonin receptor type 1A 3 Target ID: P48039 Gene ID: 4543.0 Gene Symbol: MTNR1A Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/10696085	Agonist 2678		10.55 null [pKi]
Melatonin receptor type 1B 4 Target ID: P49286 Gene ID: 4544.0 Gene Symbol: MTNR1B Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/10696085	Agonist 2678		9.87 null [pKi]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:31:25 GMT 2023` Edited by `admin` on `Sat Dec 16 11:31:25 GMT 2023`
Record UNII	2Q5TZ5754A
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

2-Iodomelatonin

Common Name

English

N-(2-(2-IODO-5-METHOXY-1H-INDOL-3-YL)ETHYL)ACETAMIDE

Systematic Name

English

N-Acetyl-2-iodo-5-methoxytryptamine

Systematic Name

English

Acetamide, N-[2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl]-

Systematic Name

English

Code System Code Type Description

PUBCHEM

115348