CHEBI:49107 - thiamine(2+)

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ChEBI Name thiamine(2+)
Definition A primary ammonium ion that is the conjugate acid of thiamine(1+) resulting from the protonation of the primary amino group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C12H18N4OS
Net Charge +2
Average Mass 266.36368
Monoisotopic Mass 266.11904
InChI InChI=1S/C12H17N4OS/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)/q+1/p+1
SMILES Cc1ncc(C[n+]2csc(CCO)c2C)c([NH3+])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(2+) (CHEBI:49107) is a primary ammonium ion (CHEBI:65296)
thiamine(2+) (CHEBI:49107) is a vitamin B1 (CHEBI:26948)
thiamine(2+) (CHEBI:49107) is conjugate acid of thiamine(1+) (CHEBI:18385)
Incoming thiamine hydrochloride (CHEBI:49105) has part thiamine(2+) (CHEBI:49107)
thiamine(1+) (CHEBI:18385) is conjugate base of thiamine(2+) (CHEBI:49107)
Synonym Source
thiamine dication ChEBI
Manual Xref Database
2620140 ChemSpider
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Registry Numbers Types Sources
3627364 Beilstein Registry Number Beilstein
677220 Gmelin Registry Number Gmelin
Last Modified
15 July 2021