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losartan carboxylic acid

PropertiesImage
MNX_IDMNXM1108319 Image of MNXM1108319
referencechebi:74125
formulaC22H21ClN6O2
global charge0
mol weight436.903
InChIKeyZEUXAIYYDDCIRX-UHFFFAOYSA-N
InChIInChI=1S/C22H21ClN6O2/c1-2-3-8-18-24-20(23)19(22(30)31)29(18)13-14-9-11-15(12-10-14)16-6-4-5-7-17(16)21-25-27-28-26-21/h4-7,9-12H,2-3,8,13H2,1H3,(H,30,31)(H,25,26,27,28)
SMILESCCCCC1=NC(Cl)=C(C(=O)O)N1CC1=CC=C(C2=CC=CC=C2C2=NN=NN2)C=C1
MNX internals
InChI (mnx)InChI=1/C22H21ClN6O2/c1-2-3-8-18-24-20(23)19(22(30)31)29(18)13-14-9-11-15(12-10-14)16-6-4-5-7-17(16)21-25-27-28-26-21/h4-7,9-12H,2-3,8,13H2,1H3,(H,30,31)(H,25,26,27,28) Image of MNXM1108319
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:8][C:18]1=[N:24][C:20]([Cl:23])=[C:19]([C:22](=[O:30])[OH:31])[N:29]1[CH2:13][C:14]1=[CH:10][CH:12]=[C:15]([C:16]2=[CH:6][CH:4]=[CH:5][CH:7]=[C:17]2[C:21]2=[N:25][NH:27][N:28]=[N:26]2)[CH:11]=[CH:9]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 6
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:74125
chebi:74125
ZEUXAIYYDDCIRX-UHFFFAOYSA-N 		losartan carboxylic acid
2-butyl-4-chloro-1-{[2'-(1H-tetrazol-5-yl)biphenyl-4-yl]methyl}-1H-imidazole-5-carboxylic acid
EXP 3174
hmdb:HMDB0060553
ZEUXAIYYDDCIRX-UHFFFAOYSA-N 		E-3174
2-N-Butyl-4-chloro-1-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methylll)imidazole-5-carboxylic acid
2-butyl-4-chloro-1-({4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl}methyl)-1H-imidazole-5-carboxylic acid
2-butyl-5-chloro-3-({4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl}methyl)imidazole-4-carboxylic acid
EXP 3174
Losartan carboxylate

kegg.compound:C15554
keggC:C15554
ZEUXAIYYDDCIRX-UHFFFAOYSA-N 		EXP 3174

sabiork.compound:32507
sabiorkM:32507
ZEUXAIYYDDCIRX-UHFFFAOYSA-N 		Losartan carboxylic acid
Carboxylosartan
E-3174

bigg.metabolite:lst4exp
biggM:lst4exp
ZEUXAIYYDDCIRX-UHFFFAOYSA-N 		Losartan-E3174/ losartan-M6

envipath:...0fae76adce4e
envipathM:...0fae76adce4e
ZEUXAIYYDDCIRX-UHFFFAOYSA-M 		compound 0067832

hmdb:HMDB60553
biggM:M_lst4exp
keggC:M_C15554 		secondary/obsolete/fantasy identifier