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thiamine diphosphate

Properties Image Occurences in reactions MNX_ID MNXM256 #reac in my sandbox 0 in MNXref (generic) 86 in models (compartimentalized) 94 formula C12H16N4O7P2S charge -2 mass 422.287 reference chebi:58937 InChIKey AYEKOFBPNLCAJY-UHFFFAOYSA-L InChI InChI=1S/C12H18N4O7P2S/c1-8-11(3-4-22-25(20,21)23-24(17,18)19)26-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7H,3-4,6H2,1-2H3,(H4-,13,14,15,17,18,19,20,21)/p-2 SMILES [CH3:1][c:8]1[c:11]([CH2:3][CH2:4][O:22][P:25](=[O:20])([O-:21])[O:23][P:24](=[O:17])([OH:18])[OH:19])[s:26][cH:7][n+:16]1[CH2:6][c:10]1[cH:5][n:14][c:9]([CH3:2])[nH:15][c:12]1=[NH:13]

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Similar chemical compounds in external resources

Identifier	Description
reactome:R-ALL-113547 reactomeM:R-ALL-113547 reactome:R-ALL-29480 reactomeM:R-ALL-29480 reactome:R-ALL-389589 reactomeM:R-ALL-389589 CHEBI:58937 chebi:58937	thiamine diphosphate 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-5-(2-{[oxido(phosphonatooxy)phosphoryl]oxy}ethyl)-1,3-thiazol-3-ium thiamin pyrophosphate thiamin pyrophosphate(2-) thiamine diphosphate dianion thiamine diphosphate(2-) thiamine pyrophosphate dianion thiamine pyrophosphate(2-) thiamine(1+) diphosphate(3-)
seed.compound:cpd00056 seedM:cpd00056	TPP TDP ThPP Thiamin diphosphate Thiamin pyrophosphate Thiamine diphosphate Thiaminediphosphate thiamin diphosphate thiamin pyrophosphate thiamin-PPi thiamine diphosphate thiamine pyrophosphate thiamine-PPi thmpp
kegg.compound:C00068 keggC:C00068	Thiamin diphosphate TPP ThPP Thiamin pyrophosphate Thiamine diphosphate
bigg.metabolite:thmpp biggM:thmpp	Thiamine diphosphate
vmhM:thmpp vmhmetabolite:thmpp	Thiamine diphosphate 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium
sabiork.compound:1287 sabiorkM:1287	Thiamine diphosphate TPP ThPP Thiamin diphosphate Thiamin pyrophosphate Thiamine pyrophosphate
hmdb:HMDB0001372	Thiamine pyrophosphate 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium Berolase Cocarboxylase Pyrophosphate, thiamine THPP TPP Thaimine pyrophosphate Thiamin diphosphate Thiamin diphosphoric acid Thiamin pyrophosphate Thiamin pyrophosphoric acid Thiamin-ppi Thiamine diphosphate Thiamine diphosphoric acid Thiamine pyrophosphoric acid Thiamine-ppi Thiamine-pyrophosphate thiamin pyrophosphate
metacyc.compound:THIAMINE-PYROPHOSPHATE metacycM:THIAMINE-PYROPHOSPHATE	thiamine diphosphate TDP TPP ThPP thiamin diphosphate thiamin pyrophosphate thiamin-PPi thiamine pyrophosphate thiamine-PPi
CHEBI:45931 chebi:45931	thiamine(1+) diphosphate(1-) 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl}ethyl dihydrogen diphosphate thiamin diphosphate thiamin pyrophosphate thiamine diphosphate thiamine pyrophosphate
CHEBI:9532 chebi:9532	thiamine(1+) diphosphate 3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-(4,6,6-trihydroxy-4,6-dioxido-3,5-dioxa-4,6-diphosphahex-1-yl)thiazolium 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-[2-(diphosphooxy)ethyl]-4-methyl-1,3-thiazol-3-ium TPP ThDP ThPP thiamin diphosphate thiamin pyrophosphate thiamine diphosphate thiamine pyrophosphate thiamine-pyrophosphate
hmdb:HMDB0062636 hmdb:HMDB01372 hmdb:HMDB62636 chebi:15229 chebi:45930 chebi:49939 biggM:M_thmpp keggC:M_C00068 seedM:M_cpd00056	secondary/obsolete/fantasy identifier