| Entry |
|
|---|
| Name |
Melatonin;
N-Acetyl-5-methoxytryptamine
|
|---|
| Formula |
C13H16N2O2
|
|---|
| Exact mass |
232.1212
|
|---|
| Mol weight |
232.2783
|
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| Structure |
     |
|---|
| Remark |
|
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| Reaction |
|
|---|
| Pathway |
| Tryptophan metabolism | | Metabolic pathways | | Neuroactive ligand-receptor interaction | | Circadian entrainment |
|
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| Enzyme |
|
|---|
| Brite |
Compounds with biological roles [BR:br08001]
Hormones and transmitters
Other hormones
Melatonin
C01598 Melatonin
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from tryptophan and anthranilic acid
Indole alkaloids
C01598 Melatonin
 |
|---|
| Other DBs |
CAS: 73-31-4 PubChem: ChEBI: PDB-CCD: 3DMET: NIKKAJI: |
|---|
| KCF data |
ATOM 17
1 C8x C 14.8400 -17.9900
2 C8y C 14.8400 -16.5900
3 C8x C 16.0300 -15.8900
4 C8y C 17.2200 -16.5900
5 C8y C 17.2200 -17.9900
6 C8x C 16.0300 -18.6900
7 C8y C 18.5500 -16.1700
8 C8x C 19.3900 -17.2900
9 N4x N 18.5500 -18.4800
10 O2a O 13.5800 -15.8900
11 C1a C 12.3900 -16.5900
12 C1b C 18.9780 -14.8370
13 C1b C 20.3381 -14.5430
14 N1b N 20.7644 -13.2167
15 C5a C 22.1544 -12.9163
16 C1a C 22.5687 -11.6239
17 O5a O 23.0957 -13.9540
BOND 18
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 2
9 8 9 1
10 5 9 1
11 2 10 1
12 10 11 1
13 7 12 1
14 12 13 1
15 13 14 1
16 14 15 1
17 15 16 1
18 15 17 2
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