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thiamine phosphate

Properties

Image

Occurences in reactions

MNX_ID

MNXM662

	#reac
in my sandbox	0
in MNXref (generic)	22
in models (compartimentalized)	20

formula

C₁₂H₁₆N₄O₄PS

charge

-1

mass

343.06354

reference

chebi:37575

InChIKey

HZSAJDVWZRBGIF-UHFFFAOYSA-M

InChI

InChI=1S/C12H17N4O4PS/c1-8-11(3-4-20-21(17,18)19)22-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7H,3-4,6H2,1-2H3,(H3-,13,14,15,17,18,19)/p-1

SMILES

Cc1ncc(C[n+]2csc(CCOP(=O)([O-])[O-])c2C)c(N)n1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:37575 chebi:37575	thiamine phosphate 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl}ethyl phosphate thiamine(1+) monophosphate(2-)
bigg.metabolite:thmmp biggM:thmmp	Thiamin monophosphate
kegg.compound:C01081 keggC:C01081	Thiamin monophosphate TMP Thiamin phosphate Thiamine monophosphate Thiamine phosphate
hmdb:HMDB0002666	Thiamine monophosphate 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-5-[2-(phosphonooxy)ethyl]-1,3-thiazol-3-ium Phosphoester, thiamine TMP ThP Thiamin monophosphate Thiamin monophosphoric acid Thiamin phosphate Thiamin phosphoric acid Thiamin-P Thiamine monophosphoric acid Thiamine phosphate Thiamine phosphoester Thiamine phosphoric acid Thiamine-Pi monoPhosphate, thiamine thiamin monophosphate
sabiork.compound:1698 sabiorkM:1698	Thiamine monophosphate TMP Thiamin monophosphate Thiamin phosphate Thiamine phosphate
seed.compound:cpd00793 seedM:cpd00793	Thiamine phosphate TMP ThP Thiamin monophosphate Thiamin phosphate Thiamine monophosphate Thiaminmonophosphate thiamin monophosphate thiamin phosphate thiamin-P thiamine monophosphate thiamine phosphate thiamine-Pi thiamine-phosphate thmmp
metacyc.compound:THIAMINE-P metacycM:THIAMINE-P	thiamine phosphate TMP ThP thiamin monophosphate thiamin phosphate thiamin-P thiamine monophosphate thiamine-Pi
CHEBI:26945 chebi:26945	thiamine phosphate thiamine phosphates
CHEBI:37574 chebi:37574	thiamine(1+) monophosphate(1-) 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl}ethyl hydrogen phosphate 3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-[2-(phosphonooxy)ethyl]thiazolium inner salt THIAMIN PHOSPHATE
CHEBI:9533 chebi:9533	thiamine(1+) monophosphate 2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-thiazol-3-ium-5-yl]ethyl dihydrogen phosphate 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl dihydrogen phosphate 2-[3-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl dihydrogen phosphate 3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-[2-(phosphonooxy)ethyl]thiazolium 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-5-[2-(phosphonooxy)ethyl]-1,3-thiazol-3-ium TMP thiamin monophosphate thiamin phosphate thiamine monophosphate thiamine phosphate vitamin B1 monophosphate vitamin B1 phosphate
hmdb:HMDB02666 chebi:15230 chebi:15231 chebi:46189 biggM:M_thmmp keggC:M_C01081 seedM:M_cpd00793	secondary/obsolete/fantasy identifier