| Entry |
|
|---|
| Name |
Scopolamine;
(-)-Hyoscine
|
|---|
| Formula |
C17H21NO4
|
|---|
| Exact mass |
303.1471
|
|---|
| Mol weight |
303.3529
|
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| Structure |
|
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| Remark |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00960 | Tropane, piperidine and pyridine alkaloid biosynthesis |
| map01064 | Biosynthesis of alkaloids derived from ornithine, lysine and nicotinic acid |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Enzyme |
|
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| Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from ornithine
Tropane alkaloids
C01851 Scopolamine
Natural toxins [BR:br08009]
Phytotoxins
Alkaloids
Tropan alkaloids
C01851 Scopolamine
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C01851
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A04 ANTIEMETICS AND ANTINAUSEANTS
A04A ANTIEMETICS AND ANTINAUSEANTS
A04AD Other antiemetics
A04AD01 Scopolamine
D00138 Scopolamine (INN) <US>
N NERVOUS SYSTEM
N05 PSYCHOLEPTICS
N05C HYPNOTICS AND SEDATIVES
N05CM Other hypnotics and sedatives
N05CM05 Scopolamine
D00138 Scopolamine (INN) <US>
S SENSORY ORGANS
S01 OPHTHALMOLOGICALS
S01F MYDRIATICS AND CYCLOPLEGICS
S01FA Anticholinergics
S01FA02 Scopolamine
D00138 Scopolamine (INN) <US>
USP drug classification [BR:br08302]
Antiemetics
Antiemetics, Other
Scopolamine
D00138 Scopolamine (INN)
Gastrointestinal Agents
Antispasmodics, Gastrointestinal
Scopolamine
D00138 Scopolamine (INN)
Risk category of Japanese OTC drugs [BR:br08312]
Second-class OTC drugs
Inorganic and organic chemicals
Scopolamine
D00138 Scopolamine (INN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01491 Muscarinic cholinergic receptor antagonist
DG00065 Scopolamine
D00138 Scopolamine
Gastrointestinal agent
DG01762 Antiemetic
DG00065 Scopolamine
D00138 Scopolamine
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM
D00138 Scopolamine (INN) <US>
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| Other DBs |
|
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| KCF data |
ATOM 22
1 C1y C 26.9500 -18.0600
2 C1y C 27.2300 -16.8700
3 C1y C 28.0700 -17.7800
4 O2x O 25.9000 -16.6600
5 C1y C 28.4200 -16.5900
6 N1y N 27.1600 -15.2600
7 C1x C 29.9600 -17.7800
8 C1x C 29.6800 -16.5900
9 C1a C 27.1600 -13.9300
10 C1y C 30.9400 -18.2700
11 O7a O 31.9900 -19.1800
12 C7a C 33.3900 -19.1800
13 O6a O 34.0900 -20.3700
14 C1c C 34.0900 -17.9900
15 C8y C 35.4900 -17.9900
16 C8x C 36.1900 -19.1800
17 C8x C 37.5900 -19.1800
18 C8x C 38.2900 -17.9900
19 C8x C 37.5900 -16.8000
20 C8x C 36.1900 -16.8000
21 C1b C 33.3900 -16.7300
22 O1a O 34.0900 -15.5400
BOND 25
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 3 6 1
6 3 7 1
7 5 8 1
8 6 9 1
9 7 10 1
10 10 11 1 #Down
11 2 4 1
12 5 6 1
13 8 10 1
14 11 12 1
15 12 13 2
16 12 14 1
17 14 15 1
18 15 16 2
19 16 17 1
20 17 18 2
21 18 19 1
22 19 20 2
23 15 20 1
24 14 21 1 #Down
25 21 22 1
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