C12H19ClN4O7P2S
460.77 g/mol
APIWarning
Vitamin B1 pyrophosphate chloride
CAS154-87-0EC205-836-1
Category
API
Compound Class
Heterocycle
Primary Use
Pharmaceutical Raw Material
This compound is the pyrophosphate ester of thiamine, serving as the biologically active coenzyme form of vitamin B1. It is an organic chloride salt that plays a central role in carbohydrate metabolism and is the predominant form of thiamine in animal tissues.
Source of thiamine (vitamin B1) in foods and dietary supplementsPresent in vegetables, meats, cereals, legumes, and yeast
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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Related Compounds
SimilarStructure SimilarSimilarity 0.83
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ReferenceSame Category
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pharmaceutical raw material
ReferenceSame Category
Itraconazole, (R)-(-)-
CAS154003-19-7
pharmaceutical raw material
ReferenceSame Category
Itraconazole, (S)-(-)-
CAS154003-20-0
pharmaceutical raw material
Referencesame scaffold
Thiamine mononitrate
CAS532-43-4
pharmaceutical intermediate
Referencesame scaffold
Thiamine
CAS59-43-8
pharmaceutical intermediate
Referencesame scaffold
Thiamine hydrochloride
CAS67-03-8
pharmaceutical raw material
Safety Reference
Warning
H317May cause an allergic skin reaction
Customs Tariff Classification
The international HS code for Vitamin B1 pyrophosphate chloride (CAS 154-87-0) is 2936.22.
HS code (international, 6-digit)
2936.22
EU CN code (8-digit)
2936 22 00
Classification per the EU customs inventory ECICS (2026-07 snapshot, HS 2022). National tariff lines and product form can affect the final classification.
Identifiers
IUPAC Name
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl phosphono hydrogen phosphate chloride
InChIKey
YXVCLPJQTZXJLH-UHFFFAOYSA-N
SMILES
CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCOP(=O)(O)OP(=O)(O)O.[Cl-]
Synonyms (64)
- Cocarboxilasa [INN-Spanish]
- Cocarboxylase (JAN/INN)
- Cocarboxylasum [INN-Latin]
- Aneurinepyrophosphoric acid
- B-Carbossilasi
- B-Neurox
- Berolase
- Biosyth
- Bioxilasi
- Bioxylasi
- Bivitasi
- COCARBOXYLASE HYDROCHLORIDE
- Co-Bi
- Cocarbina
- Cocarboxil
- Cocarboxilasa
- Cocarboxylase chloride
- Cocarboxylasum
- Cocarvit
- Coenbione
- Coenzymate (TN)
- Coenzyme-B
- Coneurina
- Cothiamine
- Coxylase
- Diphosphothiamin
- Diphosphothiamine
- Farmaneurina
- Magnesiocarbina
- Metabolase
- Nutrase
- Pyrolase
- Pyruvodehydrase
- Stadion
- TDP (thiamin ester)
- TPP (coenzyme)
- Thiamine pyrophosphoric ester
- Thiamine-PP
- Thiaminepyrophosphate
- Thiaminpyrophosphate
- Tiaxin
- cocarboxylase
- thiamine diphosphate
- thiamine diphosphate chloride
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