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Chemical Entities of Biological Interest Ontology
Last uploaded:
November 5, 2024
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| Preferred Name | perindopril | |
| Synonyms |
perindoprilum (2S,3aS,7aS)-1-[(2S)-2-{[(2S)-1-ethoxy-1-oxopentan-2-yl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid perindopril ethyl N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvalinate |
|
| Definitions |
An alpha-amino acid ester that is the ethyl ester of N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvaline |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_8024 |
|
| charge |
0
|
|
| database_cross_reference |
KEGG:C07706 Drug_Central:2108 PMID:24511479 PMID:24602481 PMID:24324048 PMID:24590580 PMID:24357222 PMID:24554346 Reaxys:4300272 LINCS:LSM-4080 PMID:24664905 Wikipedia:Perindopril DrugBank:DB00790 CAS:82834-16-0 HMDB:HMDB0014928 PMID:24515310 KEGG:D03753 PMID:24291100
|
|
| definition |
An alpha-amino acid ester that is the ethyl ester of N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvaline
|
|
| formula |
C19H32N2O5
|
|
| has role | ||
| has_exact_synonym |
ethyl N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvalinate
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|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
perindoprilum (2S,3aS,7aS)-1-[(2S)-2-{[(2S)-1-ethoxy-1-oxopentan-2-yl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid perindopril
|
|
| id |
CHEBI:8024
|
|
| in_subset | ||
| inchi |
InChI=1S/C19H32N2O5/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24/h12-16,20H,4-11H2,1-3H3,(H,23,24)/t12-,13-,14-,15-,16-/m0/s1
|
|
| inchikey |
IPVQLZZIHOAWMC-QXKUPLGCSA-N
|
|
| is conjugate acid of | ||
| label |
perindopril
|
|
| mass |
368.46786
|
|
| monoisotopicmass |
368.23112
|
|
| notation |
CHEBI:8024
|
|
| prefLabel |
perindopril
|
|
| smiles |
[H][C@@]12CCCC[C@]1([H])N([C@@H](C2)C(O)=O)C(=O)[C@H](C)N[C@@H](CCC)C(=O)OCC
|
|
| treeView |
http://purl.obolibrary.org/obo/CHEBI_46874 http://purl.obolibrary.org/obo/CHEBI_36244 |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_46874 http://purl.obolibrary.org/obo/CHEBI_36244 |
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