MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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furosemide

	Properties	Image
MNX_ID	MNXM11609
reference	chebi:47426
formula	C₁₂H₁₁ClN₂O₅S
global charge	0
mol weight	330.749
InChIKey	ZZUFCTLCJUWOSV-UHFFFAOYSA-N
InChI	InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)
SMILES	NS(=O)(=O)C1=C(Cl)C=C(NCC2=CC=CO2)C(C(=O)O)=C1

MNX internals

InChI (mnx)	InChI=1/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)
SMILES (mnx)	[CH:1]1=[CH:3][O:20][C:7]([CH2:6][NH:15][C:10]2=[CH:5][C:9]([Cl:13])=[C:11]([S:21]([NH2:14])(=[O:18])=[O:19])[CH:4]=[C:8]2[C:12](=[O:16])[OH:17])=[CH:2]1

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
Identifier	Description
CHEBI:47426 chebi:47426 ZZUFCTLCJUWOSV-UHFFFAOYSA-N	furosemide 2-Furfurylamino-4-chloro-5-sulfamoylbenzoic acid 4-Chloro-5-sulfamoyl-N-furfuryl-anthranilic acid 4-Chloro-N-(2-furylmethyl)-5-sulfamoylanthranilic acid 4-Chloro-N-furfuryl-5-sulfamoylanthranilic acid 4-chloro-2-{[(furan-2-yl)methyl]amino}-5-sulfamoylbenzoic acid Frusemide Furosemide Lasix (TN)
seed.compound:cpd19065 seedM:cpd19065 kegg.compound:C07017 keggC:C07017 ZZUFCTLCJUWOSV-UHFFFAOYSA-M ZZUFCTLCJUWOSV-UHFFFAOYSA-N	Furosemide
kegg.drug:D00331 keggD:D00331 ZZUFCTLCJUWOSV-UHFFFAOYSA-N	Furosemide (JP18/USP/INN) Frusemide Lasix (TN)
hmdb:HMDB0001933 ZZUFCTLCJUWOSV-UHFFFAOYSA-N	Furosemide 2-Furfurylamino-4-chloro-5-sulfamoylbenzoate 2-Furfurylamino-4-chloro-5-sulfamoylbenzoic acid 2-Furfurylamino-4-chloro-5-sulphamoylbenzoate 2-Furfurylamino-4-chloro-5-sulphamoylbenzoic acid 4-Chloro-5-sulfamoyl-N-furfuryl-anthranilate 4-Chloro-5-sulfamoyl-N-furfuryl-anthranilic acid 4-Chloro-5-sulphamoyl-N-furfuryl-anthranilate 4-Chloro-5-sulphamoyl-N-furfuryl-anthranilic acid 4-Chloro-N-(2-furylmethyl)-5-sulfamoylanthranilate 4-Chloro-N-(2-furylmethyl)-5-sulfamoylanthranilic acid 4-Chloro-N-(2-furylmethyl)-5-sulphamoylanthranilate 4-Chloro-N-(2-furylmethyl)-5-sulphamoylanthranilic acid 4-Chloro-N-furfuryl-5-sulfamoylanthranilate 4-Chloro-N-furfuryl-5-sulfamoylanthranilic acid 4-Chloro-N-furfuryl-5-sulphamoylanthranilate 4-Chloro-N-furfuryl-5-sulphamoylanthranilic acid 4-chloro-2-{[(furan-2-yl)methyl]amino}-5-sulfamoylbenzoic acid Acetic acid potassium salt Aisemide Aldalix Aldic Aluzine Anfuramaide Apo-frusemide Apo-furosemide Aquarid Aquasin Arasemide Beronald Bioretic Cetasix Depix Desal Desdemin Dirine Disal Discoid Disemide Diural Diurapid Diuretic salt Diurin Diurolasa Diusemide Diusil Diuzol Dranex Dryptal Durafurid Edemid Edenol Eliur Endural Errolon Eutensin Farsix Fluidrol Fluss Franyl Frumex Frumide Frumil Frusedan Frusema Frusemid Frusemide Frusemin Frusenex Frusetic Frusid Fulsix Fuluvamide Fuluvamine Furanthril Furanthryl Furantral Furantril Furanturil Furesis Furetic Furex Furfan Furix Furmid Furo-basan Furo-puren Furobeta Furocot Furodiurol Furodrix Furomen Furomex Furomide m.d. Furorese Furosan Furose Furosedon Furosemid Furosemida Furosemide "mita" Furosemide monohydrochloride Furosemide monosodium salt Furosemidu Furosemidum Furosemix Furoside Furosifar Furosix Furoter Furovite Fursemid Fursemida Fursemide Fursol Fusid Fusidic acid Golan Hissuflux Hydrex Hydro Hydro-rapid Hydroled Impugan Jenafusid Katlex Kofuzon Kolkin Kutrix Lasemid Lasex Lasiletten Lasilix Lasix Lasix retard Laxur Lazix Less diur Liside Logirene Lowpston Lowpstron Luscek Macasirool Marsemide Mirfat Mita Moilarorin Nadis Nelsix Neo-renal Nephron Nicorol Novosemide Octan draselny Odemase Odemex Oedemex Osyrol Polysquall a Prefemin Profemin Promedes Promide Protargen Puresis Radisemide Radonna Radouna Retep Rosemide Rosis Rusyde Sal diureticum Salinex Salix Salix (brand OF furosemide) Salurex Salurid Seguril Selectofur Sigasalur Spirofur Synephron Transit Trofurit Uremide Uresix Urex Urex-m Urian Uridon Uritol Urosemide Vesix Yidoli Zafimida furosemide
envipath:...c63edf1c970c envipathM:...c63edf1c970c ZZUFCTLCJUWOSV-UHFFFAOYSA-N	compound 0049058
hmdb:HMDB01933 chebi:47425 chebi:5198 keggC:M_C07017 keggD:M_D00331 seedM:M_cpd19065	secondary/obsolete/fantasy identifier