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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
| Id | http://purl.obolibrary.org/obo/CHEBI_601027
http://purl.obolibrary.org/obo/CHEBI_601027
|
|---|---|
| Preferred Name | aliskiren |
| Synonyms |
(2S,4S,5S,7S)-5-amino-N-(2-carbamoyl-2,2-dimethylethyl)-4-hydroxy-7-{[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl}-8-methyl-2-(propan-2-yl)nonanamide
(2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[4-methoxy-3-(3-methoxypropoxy)benzyl]-8-methyl-2-(propan-2-yl)nonanamide
aliskiren
SPP 100
C30H53N3O6
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | aliskiren
|
|---|---|
| label | aliskiren
|
| DBSynonym |
rasilez
spp 100
|
| ATCCode | C09XA02
|
| Definition | A monomethoxybenzene compound having a 3-methoxypropoxy group at the 2-position and a multi-substituted branched alkyl substituent at the 4-position.
|
| altId |
CHEBI:41356
CHEBI:580746
|
| has effect |
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|
| has pharmacological target | |
| inhibits | |
| type | |
| has role | |
| InChIKey | InChIKey=UXOWGYHJODZGMF-QORCZRPOSA-N
|
| is metabolised by | |
| Synonym | (2S,4S,5S,7S)-5-amino-N-(2-carbamoyl-2,2-dimethylethyl)-4-hydroxy-7-{[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl}-8-methyl-2-(propan-2-yl)nonanamide
(2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[4-methoxy-3-(3-methoxypropoxy)benzyl]-8-methyl-2-(propan-2-yl)nonanamide
aliskiren
SPP 100
C30H53N3O6
|
| xref |
ChemSpider:4591452
PharmGKB:PA143487910
DrugBank:DB01258
ChEMBL:19358611
DrugBank:173334-57-1
PDBeChem:C41
CASRN:173334-57-1
BindingDB:17950
KEGG DRUG:D03208
National Drug Code Directory:0078-0486-15
Wikipedia:Aliskiren
Wikipedia:http://en.wikipedia.org/wiki/Aliskiren
Beilstein:8740878
Drugs.com:http://www.drugs.com/cdi/aliskiren.html
ChEMBL:19457666
PubChem Compound:5493444
ChEBI:601027
PubChem Substance:46507474
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|
| CASRN | 173334-57-1
|
| prefixIRI | obo2:CHEBI_601027
|
| SMILES |
COCCCOC1=C(OC)C=CC(C[C@@H](C[C@H](N)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)(C)C(N)=O)C(C)C)=C1
COCCCOc1cc(C[C@@H](C[C@H](N)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)(C)C(N)=O)C(C)C)ccc1OC
|
| may interact with | |
| DBname | aliskiren
|
| InChI | InChI=1S/C30H53N3O6/c1-19(2)22(14-21-10-11-26(38-8)27(15-21)39-13-9-12-37-7)16-24(31)25(34)17-23(20(3)4)28(35)33-18-30(5,6)29(32)36/h10-11,15,19-20,22-25,34H,9,12-14,16-18,31H2,1-8H3,(H2,32,36)(H,33,35)/t22-,23-,24-,25-/m0/s1
|
| DBBrand |
rasilez
tekturna
|
| subClassOf |
| Delete | Subject | Author | Type | Created |
|---|---|---|---|---|
| No notes to display |