Cocarboxylase
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Cocarboxylase
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CAS No:
154-87-0
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Formula:
C12H19N4O7P2S.Cl
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Chemical Name:
Cocarboxylase
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Synonyms:
ANEURINEPYROPHOSPHORIC ACID;COCARBOXYLASE;COCARBOXYLASE CHLORIDE;Thiamine, pyrophosphoric acid ester;[2-[3-[(4-Amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-5-yl]ethoxy-hydroxy-phosphoryl]oxyphosphonic acid chloride;Thiamine diphosphate chloride;Vitamin B1;Aneurinepyrophosphoric acid, Cocarboxylase, Thiamine pyrophosphate chloride
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CAS No:
Description
The active coenzyme form of vitamin B1 which functions in aldehyde transfer reactions.
Thiamine(1+) diphosphate chloride is an organic chloride salt of thiamine(1+) diphosphate. It is an organic chloride salt and a vitamin B1. It contains a thiamine(1+) diphosphate.|The coenzyme form of Vitamin B1 present in many animal tissues. It is a required intermediate in the PYRUVATE DEHYDROGENASE COMPLEX and the KETOGLUTARATE DEHYDROGENASE COMPLEX.
Best known as the anti-beriberi factor and called at first simply vitamin B by McCollum, thiamine was shown to be involved in the decarboxylation of pyruvate to acetaldehyde in alcohol fermentation and was named ‘cocarboxylase’ in 1932. Confirmation of its structure as TPP came 5 years later. Its name is meant to signify a vitamin containing sulfur (thios in Greek).
Certified pharmaceutical secondary standards for application in quality control, provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards. Thiamine pyrophosphate is a coenzyme of transketolase that catalyzes the cleavage of ribulose-5-phosphate; thereby forming D-glyceraldehyde-3-phosphate. This reaction requires the addition of an acceptor aldehyde such as ribose-5-phosphate, glyceraldehye or glycolaldehyde.
Cocarboxylase Basic Attributes
460.77
460.013824
3875902
205-836-1
XMK8K8EVIU
TSCA listed
DTXSID6046262
White to Off-White
29362200
Characteristics
197
240～241℃
It is soluble in water.
2-8°C
LD50 intramuscular in mouse: > 1gm/kg
1.0-1.4 (20°C, 100g/L in H2O)
5.82
182 Ų [M]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|181.8 Ų [M]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|186.8 Ų [M+Na-H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|178.2 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]
-20°C
Drug Information
A group of water-soluble vitamins, some of which are COENZYMES. (See all compounds classified as Vitamin B Complex.)
Berolase
Cocarboxylase Use and Manufacturing
decarboxylation mechanisms in biological systems,and to investigate radical reactions of thiamin pyrophosphate in 2-oxoacid oxidoreductases.
Thiamine Pyrophosphate (Cocarboxylase) is a thiamine (T344185) derivative produced by enzyme thiamine pyrophosphatase. Thiamine pyrophosphate is a cofactor used to catalyze various biochemical reactions.
Thiazolium, 3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-(4,6,6-trihydroxy-4,6-dioxido-3,5-dioxa-4,6-diphosphahex-1-yl)-, chloride (1:1): ACTIVE
Computed Properties
Molecular Weight:460.77
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:8
Exact Mass:460.0138218
Monoisotopic Mass:460.0138218
Topological Polar Surface Area:197
Heavy Atom Count:27
Complexity:568
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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