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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
| Id | http://purl.obolibrary.org/obo/CHEBI_16794
http://purl.obolibrary.org/obo/CHEBI_16794
|
|---|---|
| Preferred Name | scopolamine |
| Synonyms |
alpha-(Hydroxymethyl)benzeneacetic acid 9-methyl-3-oxa-9-azatricyclo(3.3.1.0(2.4))non-7-yl ester
(-)-scopolamine
(1R,2R,4S,5S,7S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0^{2,4}]nonan-7-yl (2S)-3-hydroxy-2-phenylpropanoate
(1S,3S,5R,6R,7S)-6,7-epoxytropan-3-yl (2S)-3-hydroxy-2-phenylpropanoate
(1R,2R,4S,5S,7S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl (2S)-3-hydroxy-2-phenylpropanoate
Hyoscine
(-)-hyoscine
6-beta,7-beta-Epoxy-3-alpha-tropanyl S-(-)-tropate
Transderm-Scop
6,7-Epoxytropine tropate
Scopolamine
C17H21NO4
scopine (-)-tropate
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|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | scopolamine
|
|---|---|
| label | scopolamine
|
| DBSynonym |
(-)-scopolamine
scopine (?)-tropate
(-)-hyoscine
hyoscine
levo-duboisine
|
| ATCCode |
N05CM05
A04AD01
S01FA02
|
| Definition | A tropane alkaloid that is the (S)-tropic acid ester of 6beta,7beta-epoxy-1alphaH,5alphaH-tropan-3alpha-ol.
|
| altId |
CHEBI:15066
CHEBI:26610
CHEBI:9056
|
| has effect |
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| DBSalt |
scopolamine bromide
scopolamine hydrobromide trihydrate
scopolamine hyoscine
scopolamine hydrobromide
|
| has pharmacological target | |
| inhibits | |
| type | |
| has role |
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| InChIKey | InChIKey=STECJAGHUSJQJN-FWXGHANASA-N
|
| blocks | |
| AHFScode | 12:08.08
|
| Synonym | alpha-(Hydroxymethyl)benzeneacetic acid 9-methyl-3-oxa-9-azatricyclo(3.3.1.0(2.4))non-7-yl ester
(-)-scopolamine
(1R,2R,4S,5S,7S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0^{2,4}]nonan-7-yl (2S)-3-hydroxy-2-phenylpropanoate
(1S,3S,5R,6R,7S)-6,7-epoxytropan-3-yl (2S)-3-hydroxy-2-phenylpropanoate
(1R,2R,4S,5S,7S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl (2S)-3-hydroxy-2-phenylpropanoate
Hyoscine
(-)-hyoscine
6-beta,7-beta-Epoxy-3-alpha-tropanyl S-(-)-tropate
Transderm-Scop
6,7-Epoxytropine tropate
Scopolamine
C17H21NO4
scopine (-)-tropate
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|
| xref |
Wikipedia:http://en.wikipedia.org/wiki/Scopolamine
DrugBank:DB00747
Drugs Product Database (DPD):2229868
HMDB:HMDB03573
Guide To Pharmacology:330
Reaxys:91904
ChEMBL:679689
IUPHAR:330
Wikipedia:Scopolamine
MetaCyc:SCOPOLAMINE
KEGG DRUG:D00138
PharmGKB:PA451308
CiteXplore:23334071
BindingDB:50015720
NIST Chemistry WebBook:51-34-3
ChEBI:16794
CASRN:51-34-3
CiteXplore:11718188
KEGG COMPOUND:C01851
Drugs.com:http://www.drugs.com/cdi/scopolamine-drops.html
National Drug Code Directory:0067-4345-04
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| CASRN | 51-34-3
|
| prefixIRI | obo2:CHEBI_16794
|
| SMILES |
CN1[C@H]2C[C@@H](C[C@@H]1[C@H]1O[C@@H]21)OC(=O)[C@H](CO)c1ccccc1
CN1[C@H]2C[C@@H](C[C@@H]1[C@H]1O[C@@H]21)OC(=O)[C@H](CO)C1=CC=CC=C1
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| may interact with |
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| DBname | scopolamine
|
| InChI | InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11-,12-,13-,14+,15-,16+/m1/s1
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| DBBrand | transderm-scop
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| subClassOf |
| Delete | Subject | Author | Type | Created |
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