| Entry |
|
|---|
| Name |
5-Hydroxy-L-tryptophan;
Oxitriptan
|
|---|
| Formula |
C11H12N2O3
|
|---|
| Exact mass |
220.0848
|
|---|
| Mol weight |
220.22
|
|---|
| Structure |
|
|---|
| Remark |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01063 | Biosynthesis of alkaloids derived from shikimate pathway |
|
|---|
| Module |
| M00037 | Melatonin biosynthesis, animals, tryptophan => serotonin => melatonin |
|
|---|
| Enzyme |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N06 PSYCHOANALEPTICS
N06A ANTIDEPRESSANTS
N06AX Other antidepressants
N06AX01 Oxitriptan
D07339 Oxitriptan (INN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 16
1 C8y C 25.4100 -15.8200
2 C8y C 25.4100 -17.2200
3 C8y C 26.7400 -15.4000
4 C8x C 24.1500 -15.1200
5 N4x N 26.6700 -17.6400
6 C8x C 24.1500 -17.9200
7 C8x C 27.5100 -16.5200
8 C8y C 22.9600 -15.8200
9 C8x C 22.9600 -17.2200
10 O1a O 21.7700 -15.0500
11 C1b C 27.2300 -14.0700
12 C1c C 28.5600 -13.7900
13 N1a N 29.5400 -14.9100
14 C6a C 28.9800 -12.4600
15 O6a O 30.3800 -12.1800
16 O6a O 28.0700 -11.4100
BOND 17
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 4 8 2
8 6 9 2
9 8 10 1
10 5 7 1
11 8 9 1
12 3 11 1
13 11 12 1
14 12 13 1 #Up
15 12 14 1
16 14 15 1
17 14 16 2
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|---|
