Microbial Conditions Ontology

Last uploaded: September 4, 2019
Preferred Name

thiamine hydrochloride

Synonyms

3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium chloride hydrochloride

3-[(4-azaniumyl-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium dichloride

thiamine chloride hydrochloride

DPJRMOMPQZCRJU-UHFFFAOYSA-M

thiamine dichloride

thiaminium chloride hydrochloride

thiamine HCl

thiamine(2+) dichloride

InChI=1S/C12H17N4OS.2ClH/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);2*1H/q+1;;/p-1

336.058

C12H17N4OS.HCl.Cl

0

337.270

C12H18Cl2N4OS

C([N+]=1C(=C(SC1)CCO)C)C=2C(=NC(C)=NC2)N.[Cl-].Cl

Definitions

A hydrochloride obtained by combining thiamine chloride with one molar equivalent of hydrochloric acid.

ID

http://purl.obolibrary.org/obo/CHEBI_49105

database_cross_reference

Reaxys:17124533

KEGG:D02094

PMID:12224421

Gmelin:691133

CAS:67-03-8

Gmelin:31154

PMID:26616989

PMID:27163892

Wikipedia:Thiamine

Beilstein:3642937

Beilstein:3851771

has exact synonym

3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium chloride hydrochloride

3-[(4-azaniumyl-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium dichloride

has part

http://purl.obolibrary.org/obo/CHEBI_49107

has_obo_namespace

chebi_ontology

has_related_synonym

thiamine chloride hydrochloride

DPJRMOMPQZCRJU-UHFFFAOYSA-M

thiamine dichloride

thiaminium chloride hydrochloride

thiamine HCl

thiamine(2+) dichloride

InChI=1S/C12H17N4OS.2ClH/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);2*1H/q+1;;/p-1

336.058

C12H17N4OS.HCl.Cl

0

337.270

C12H18Cl2N4OS

C([N+]=1C(=C(SC1)CCO)C)C=2C(=NC(C)=NC2)N.[Cl-].Cl

id

CHEBI:49105

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

label

thiamine hydrochloride

notation

CHEBI:49105

prefLabel

thiamine hydrochloride

textual definition

A hydrochloride obtained by combining thiamine chloride with one molar equivalent of hydrochloric acid.

subClassOf

http://purl.obolibrary.org/obo/CHEBI_36807

http://purl.obolibrary.org/obo/CHEBI_26948

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