| Entry |
|
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| Name |
L-Hyoscyamine;
L-Tropine tropate;
Daturine;
Duboisine
|
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| Formula |
C17H23NO3
|
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| Exact mass |
289.1678
|
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| Mol weight |
289.3694
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| Structure |
|
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| Remark |
|
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| Reaction |
|
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| Pathway |
| map00960 | Tropane, piperidine and pyridine alkaloid biosynthesis |
| map01064 | Biosynthesis of alkaloids derived from ornithine, lysine and nicotinic acid |
| map01110 | Biosynthesis of secondary metabolites |
|
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| Enzyme |
|
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| Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from ornithine
Tropane alkaloids
C02046 L-Hyoscyamine
Natural toxins [BR:br08009]
Phytotoxins
Alkaloids
Tropan alkaloids
C02046 L-Hyoscyamine
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A03 DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03B BELLADONNA AND DERIVATIVES, PLAIN
A03BA Belladonna alkaloids, tertiary amines
A03BA03 Hyoscyamine
D00147 Hyoscyamine (USP)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01491 Muscarinic cholinergic receptor antagonist
DG00053 Hyoscyamine
D00147 Hyoscyamine
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM
D00147 Hyoscyamine (USP)
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| Other DBs |
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| KCF data |
ATOM 21
1 C1x C 20.1138 -19.1608
2 C1x C 20.4419 -17.9891
3 C1y C 21.2855 -18.8796
4 C1y C 21.6136 -17.7079
5 N1y N 20.3482 -16.3956
6 C1x C 23.1602 -18.8796
7 C1x C 22.8790 -17.7079
8 C1y C 24.1913 -19.4420
9 O7a O 25.2693 -20.3325
10 C7a C 26.4879 -20.3325
11 C1c C 27.0972 -19.2545
12 O6a O 27.0972 -21.4573
13 C8y C 28.3158 -19.2545
14 C1b C 26.4879 -18.2234
15 O1a O 27.0972 -17.1455
16 C8x C 29.0220 -20.4782
17 C8x C 30.4220 -20.4785
18 C8x C 31.1222 -19.2662
19 C8x C 30.4161 -18.0425
20 C8x C 29.0161 -18.0422
21 C1a C 19.5991 -15.2114
BOND 23
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 3 6 1
6 4 7 1
7 6 8 1
8 8 9 1 #Down
9 9 10 1
10 10 11 1
11 10 12 2
12 11 13 1
13 11 14 1 #Down
14 14 15 1
15 4 5 1
16 7 8 1
17 13 16 2
18 16 17 1
19 17 18 2
20 18 19 1
21 19 20 2
22 13 20 1
23 5 21 1
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