CHEBI:33283 - thiamine(1+) chloride

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ChEBI Name thiamine(1+) chloride
ChEBI ID CHEBI:33283
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
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Thiamine, also known as thiamin and vitamin B1, is a vitamin, an essential micronutrient for humans and animals. It is found in food and commercially synthesized to be a dietary supplement or medication. Phosphorylated forms of thiamine are required for some metabolic reactions, including the breakdown of glucose and amino acids. Food sources of thiamine include whole grains, legumes, and some meats and fish. Grain processing removes much of the vitamin content, so in many countries cereals and flours are enriched with thiamine. Supplements and medications are available to treat and prevent thiamine deficiency and the disorders that result from it such as beriberi and Wernicke encephalopathy. They are also used to treat maple syrup urine disease and Leigh syndrome. Supplements and medications are typically taken by mouth, but may also be given by intravenous or intramuscular injection. Thiamine supplements are generally well tolerated. Allergic reactions, including anaphylaxis, may occur when repeated doses are given by injection. Thiamine is on the World Health Organization's List of Essential Medicines. It is available as a generic medication, and in some countries as a non-prescription dietary supplement. In 2022, it was the 288th most commonly prescribed medication in the United States, with more than 500,000 prescriptions.
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Formula C12H17ClN4OS
Net Charge 0
Average Mass 300.80844
Monoisotopic Mass 300.08116
InChI InChI=1S/C12H17N4OS.ClH/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);1H/q+1;/p-1
InChIKey MYVIATVLJGTBFV-UHFFFAOYSA-M
SMILES [Cl-].Cc1ncc(C[n+]2csc(CCO)c2C)c(N)n1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): water-soluble vitamin (role)
Any vitamin that dissolves in water and readily absorbed into tissues for immediate use. Unlike the fat-soluble vitamins, they are not stored in the body and need to be replenished regularly in the diet and will rarely accumulate to toxic levels since they are quickly excreted from the body via urine.
(via B vitamin )
Application(s): nutraceutical
A product in capsule, tablet or liquid form that provide essential nutrients, such as a vitamin, an essential mineral, a protein, an herb, or similar nutritional substance.
(via B vitamin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing thiamine(1+) chloride (CHEBI:33283) has part thiamine(1+) (CHEBI:18385)
thiamine(1+) chloride (CHEBI:33283) is a organic chloride salt (CHEBI:36094)
thiamine(1+) chloride (CHEBI:33283) is a vitamin B1 (CHEBI:26948)
IUPAC Name
3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium chloride
INNs Sources
thiamine WHO MedNet
thiamine WHO MedNet
thiaminum WHO MedNet
tiamina WHO MedNet
Synonyms Sources
3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-5-(2-hydroxyethyl)-4-methylthiazolium chloride ChemIDplus
Thiamin ChemIDplus
thiamine chloride DrugBank
thiamine monochloride ChemIDplus
vitamin B1 ChemIDplus
Manual Xrefs Databases
5819 ChemSpider
D08580 KEGG DRUG
DBSALT002650 DrugBank
Thiamine Wikipedia
View more database links
Registry Numbers Types Sources
318226 Gmelin Registry Number Gmelin
3581326 Beilstein Registry Number Beilstein
59-43-8 CAS Registry Number ChemIDplus
Citations
Last Modified
15 July 2021