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allopurinol

Properties Image MNX_ID MNXM726418 reference chebi:40279 formula C5H4N4O global charge 0 mol weight 136.114 InChIKey OFCNXPDARWKPPY-UHFFFAOYSA-N InChI InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10) SMILES OC1=NC=NC2=C1C=NN2 MNX internals InChI (mnx) InChI=1/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10) SMILES (mnx) [CH:1]1=[C:3]2[C:4](=[N:9][NH:8]1)[N:6]=[CH:2][N:7]=[C:5]2[OH:10]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 5

Similar chemical compounds in external resources

Identifier	Description
CHEBI:40279 chebi:40279 OFCNXPDARWKPPY-UHFFFAOYSA-N	allopurinol 1,5-Dihydro-4H-pyrazolo(3,4-d)pyrimidin-4-one 1,5-Dihydro-4H-pyrazolo(3,4-d)pyrimidine-4-one 1H-Pyrazolo(3,4-d)pyrimidin-4-ol 1H-pyrazolo[3,4-d]pyrimidin-4-ol 4'-Hydroxypyrazolol(3,4-d)pyrimidine 4-HPP 4-Hydroxy-1H-pyrazolo(3,4-d)pyrimidine 4-Hydroxy-3,4-pyrazolopyrimidine 4-Hydroxypyrazolo(3,4-d)pyrimidine 4-Hydroxypyrazolopyrimidine 4-Hydroxypyrazolyl(3,4-d)pyrimidine 4H-Pyrazolo(3,4-d)pyrimidin-4-one AL-100 Allopurinol Allopurinolum Alopurinol Zyloprim (TN)
bigg.metabolite:allop biggM:allop sabiork.compound:8940 sabiorkM:8940 OFCNXPDARWKPPY-UHFFFAOYSA-N	Allopurinol
kegg.drug:D00224 keggD:D00224 OFCNXPDARWKPPY-UHFFFAOYSA-N	Allopurinol (JP18/USP/INN) Zyloprim (TN)
hmdb:HMDB0014581 OFCNXPDARWKPPY-UHFFFAOYSA-N	Allopurinol 1,5-Dihydro-4H-pyrazolo(3,4-D)pyrimidin-4-one 1,5-Dihydro-4H-pyrazolo(3,4-D)pyrimidine-4-one 1H,2H,4H-pyrazolo[3,4-d]pyrimidin-4-one 1H-Pyrazolo(3,4-D)pyrimidin-4-ol 4'-Hydroxypyrazolol(3,4-D)pyrimidine 4-HPP 4-Hydroxy-1H-pyrazolo(3,4-D)pyrimidine 4-Hydroxy-3,4-pyrazolopyrimidine 4-Hydroxypyrazolo(3,4-D)pyrimidine 4-Hydroxypyrazolopyrimidine 4-Hydroxypyrazolyl(3,4-D)pyrimidine 4H-Pyrazolo(3,4-D)pyrimidin-4-one AL-100 ALLO APS brand OF allopurinol Allohexal Allohexan Alloprin Allopurin Allopurinol alphapharm brand Allopurinol amrad brand Allopurinol aps brand Allopurinol ashbourne brand Allopurinol azupharma brand Allopurinol basf brand Allopurinol bicther brand Allopurinol boots brand Allopurinol clonmel brand Allopurinol dorsch brand Allopurinol douglas brand Allopurinol gepepharm brand Allopurinol hennig brand Allopurinol hexal brand Allopurinol horner brand Allopurinol icn brand Allopurinol jenapharm brand Allopurinol merckle brand Allopurinol merz brand Allopurinol multipharma brand Allopurinol nicholas brand Allopurinol novopharm brand Allopurinol pharmafarm brand Allopurinol pinewood brand Allopurinol protea brand Allopurinol r.a.n. brand Allopurinol rima brand Allopurinol roche brand Allopurinol rosen brand Allopurinol rougier brand Allopurinol tad brand Allopurinol thiemann brand Allopurinol wellcome brand Allopurinolum Allorin Allpargin Allural Alopurinol Alphapharm brand OF allopurinol Amrad brand OF allopurinol Apulonga Apurin Ashbourne brand OF allopurinol Atisuril Azupharma brand OF allopurinol BASF brand OF allopurinol Bicther brand OF allopurinol Bleminol Boehringer mannheim brand OF allopurinol Boots brand OF allopurinol Byk gulden brand OF allopurinol Caplenal Capurate Cellidrin Clonmel brand OF allopurinol Dorsch brand OF allopurinol Douglas brand OF allopurinol Embarin Fawns and mcallan brand OF allopurinol Foligan Gepepharm brand OF allopurinol Glaxo wellcome brand OF allopurinol Hamarin Hennig brand OF allopurinol Henning berlin brand OF allopurinol Hexal brand OF allopurinol Horner brand OF allopurinol ICN brand OF allopurinol Jenapharm brand OF allopurinol Jenapurinol Lopurin Lysuron Merckle brand OF allopurinol Merz brand OF allopurinol Milurit Milurite Multipharma brand OF allopurinol Nicholas brand OF allopurinol Novopharm brand OF allopurinol Novopurol Pan quimica Pharmafarm brand OF allopurinol Pinewood brand OF allopurinol Progout Protea brand OF allopurinol Pureduct Purinol Quimica, pan R.A.N. brand OF allopurinol Reig jofre brand OF allopurinol Remid Rhone poulenc rorer brand OF allopurinol Rhone-poulenc rorer brand OF allopurinol Rima brand OF allopurinol Rimapurinol Roche brand OF allopurinol Rosen brand OF allopurinol Roucol Rougier brand OF allopurinol Suspendol TAD brand OF allopurinol Thiemann brand OF allopurinol Tipuric Uribenz Uridocid Uripurinol Urosin Urtias Wellcome brand OF allopurinol Xanthomax Xanturic Zygout Zyloprim Zyloric
metacyc.compound:CPD-9024 metacycM:CPD-9024 seed.compound:cpd25535 seedM:cpd25535 OFCNXPDARWKPPY-UHFFFAOYSA-M OFCNXPDARWKPPY-UHFFFAOYSA-N	allopurinol
vmhM:allop vmhM:allop vmhmetabolite:allop vmhmetabolite:allop OFCNXPDARWKPPY-UHFFFAOYSA-N	allopurinol 1H,2H,4H-pyrazolo[3,4-d]pyrimidin-4-one
envipath:...672b1938bab6 envipathM:...672b1938bab6 OFCNXPDARWKPPY-UHFFFAOYSA-N	compound 0064269
envipath:...2876d18bfc7e envipathM:...2876d18bfc7e OFCNXPDARWKPPY-UHFFFAOYSA-N	compound 0215396
hmdb:HMDB14581 chebi:2601 chebi:40276 biggM:M_allop keggD:M_D00224 seedM:M_cpd25535 vmhM:M_allop	secondary/obsolete/fantasy identifier