Benfotiamine
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Benfotiamine
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CAS No:
22457-89-2
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Formula:
C19H23N4O6PS
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Chemical Name:
Benfotiamine
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Synonyms:
Benzenecarbothioic acid,S-[2-[[(4-amino-2-methyl-5-pyrimidinyl)methyl]formylamino]-1-[2-(phosphonooxy)ethyl]-1-propen-1-yl] ester;Benzoic acid,thio-,S-ester with N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-(4-hydroxy-2-mercapto-1-methyl-1-butenyl)formamide dihydrogen phosphate (ester);Benzenecarbothioic acid,S-[2-[[(4-amino-2-methyl-5-pyrimidinyl)methyl]formylamino]-1-[2-(phosphonooxy)ethyl]-1-propenyl] ester;Formamide,N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-(4-hydroxy-2-mercapto-1-methyl-1-butenyl)-,S-benzoate O-(dihydrogen phosphate);N-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-N-(4-hydroxy-2-mercapto-1-methyl-1-butenyl)formamide S-benzoate O-phosphate;Benfotiamine;Benzoylthiamine monophosphate;Benzoylthiamine O-monophosphate;S-Benzoylthiamine monophosphate;S-Benzoylthiamine O-monophosphate;Biotamin;BTMP;Nitanevril;Neurostop;Vitanevril;Berdi;Betivina;Bietamine;Tabiomyl;Benfothiamine;8088CB;Milgamma;137-74-6
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CAS No:
Description
Benfotiamine is a synthetic S-acyl derivative of thiamine (vitamin B1); an antioxidant dietary supplement.IC50 value:Target: Benfotiamine, the lipid-soluble thiamine derivative used as a treatment for diabetic neuropathy, can inhibit three major pathways(the hexosamine pathway, the advanced glycation end product (AGE) formation pathway and the diacylglycerol (DAG)?protein kinase C (PKC) pathway）of hyperglycemic damage and prevent experimental diabetic retinopathy. Benfotiamine is a synth
Benfotiamine Basic Attributes
466.45
466.45
245-013-4
Y92OUS2H9B
DTXSID3045433
A - Alimentary tract and metabolism
Characteristics
181
3.84720
shinning black powder
1.4±0.1 g/cm3
165 °C (decomp)
745.1°C at 760 mmHg
404.4±35.7 °C
1.645
2-8°C
2.55E-23mmHg at 25°C
Drug Information
Chemicals that bind to and remove ions from solutions. Many chelating agents function through the formation of COORDINATION COMPLEXES with METALS. (See all compounds classified as Chelating Agents.)|Substances that augment, stimulate, activate, potentiate, or modulate the immune response at either the cellular or humoral level. The classical agents (Freund's adjuvant, BCG, Corynebacterium parvum, et al.) contain bacterial antigens. Some are endogenous (e.g., histamine, interferon, transfer factor, tuftsin, interleukin-1). Their mode of action is either non-specific, resulting in increased immune responsiveness to a wide variety of antigens, or antigen-specific, i.e., affecting a restricted type of immune response to a narrow group of antigens. The therapeutic efficacy of many biological response modifiers is related to their antigen-specific immunoadjuvanticity. (See all compounds classified as Adjuvants, Immunologic.)
benfothiamine
Benfotiamine Use and Manufacturing
Vitamin B1 analog. Synthetic S-acyl derivative of Thiamine (T344185).
Computed Properties
Molecular Weight:466.4
XLogP3:0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:10
Exact Mass:466.10759264
Monoisotopic Mass:466.10759264
Topological Polar Surface Area:181
Heavy Atom Count:31
Complexity:697
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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