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perindoprilat

PropertiesImage
MNX_IDMNXM159570 Image of MNXM159570
referencechebi:132041
formulaC17H28N2O5
global charge0
mol weight340.42
InChIKeyODAIHABQVKJNIY-PEDHHIEDSA-N
InChIInChI=1S/C17H28N2O5/c1-3-6-12(16(21)22)18-10(2)15(20)19-13-8-5-4-7-11(13)9-14(19)17(23)24/h10-14,18H,3-9H2,1-2H3,(H,21,22)(H,23,24)/t10-,11-,12-,13-,14-/m0/s1
SMILESCCC[C@H](N[C@@H](C)C(=O)N1[C@H](C(=O)O)C[C@@H]2CCCC[C@@H]21)C(=O)O
MNX internals
InChI (mnx)InChI=1/C17H28N2O5/c1-3-6-12(16(21)22)18-10(2)15(20)19-13-8-5-4-7-11(13)9-14(19)17(23)24/h10-14,18H,3-9H2,1-2H3,(H,21,22)(H,23,24)/t10-,11-,12-,13-,14-/m0/s1 Image of MNXM159570
SMILES (mnx)[CH3:1][CH2:3][CH2:6][C@@H:12]([C:16](=[O:21])[OH:22])[NH:18][C@@H:10]([CH3:2])[C:15]([N:19]1[C@H:13]2[CH2:8][CH2:5][CH2:4][CH2:7][C@H:11]2[CH2:9][C@H:14]1[C:17](=[O:23])[OH:24])=[O:20]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-9614952
reactomeM:R-ALL-9614952
reactome:R-ALL-9619044
reactomeM:R-ALL-9619044
CHEBI:132041
chebi:132041
ODAIHABQVKJNIY-PEDHHIEDSA-N 		perindoprilat
(2S,3aS,7aS)-1-[(2S)-2-{[(1S)-1-carboxybutyl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid
N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvaline
S 9780
S-9780
perindoprilate
perindoprilato
perindoprilatum
perondropilat

kegg.compound:C21517
keggC:C21517
ODAIHABQVKJNIY-PEDHHIEDSA-N 		Perindoprilat
hmdb:HMDB0060574
ODAIHABQVKJNIY-PEDHHIEDSA-N 		Perindoprilat
(2S,3AS,7as)-1-[(2S)-2-{[(1S)-1-carboxybutyl]amino}propanoyl]octahydro-1H-indole-2-carboxylate
(2S,3AS,7as)-1-[(2S)-2-{[(1S)-1-carboxybutyl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acid
(2S,3aS,7aS)-1-[(2S)-2-{[(1S)-1-carboxybutyl]amino}propanoyl]-octahydro-1H-indole-2-carboxylic acid
(2S,3aS,7aS)-1-[(2S)-2-{[(1S)-1-carboxybutyl]amino}propanoyl]-octahydroindole-2-carboxylic acid
Perindoprilate
Perindoprilato
Perindoprilatum
Perindoprilic acid
Perondropilat
S 9780
S-9780

hmdb:HMDB60574
keggC:M_C21517 		secondary/obsolete/fantasy identifier