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599-54-2

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599-54-2 Structure

599-54-2 Structure

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[Name] (±)-N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-beta-alanine
[CAS] 599-54-2
[Synonyms] DL-Pantothenic acid Pantothenic acid, DL- (8CI) β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)- (±)-N-(2,4-Dihydroxy-3,3-dimethyl-1-oxobutyl)-β-alanine rac-N-[(S*)-2,4-Dihydroxy-3,3-dimethylbutyryl]-β-alanine (±)-N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-beta-alanine 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoic acid 3-[(2,4-dihydroxy-3,3-dimethyl-butanoyl)amino]propanoic acid 3-[(2,4-dihydroxy-3,3-dimethyl-butanoyl)amino]propionic acid β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, (+-)-
[EINECS(EC#)] 209-965-4
[Molecular Formula] C9H17NO5
[MOL File] 599-54-2.mol
[Molecular Weight] 219.24

Chemical Properties	Back Directory
[Boiling point ] 551.5±50.0 °C(Predicted)
[density ] 1.266±0.06 g/cm3(Predicted)
[pka] 4.30±0.10(Predicted)

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[Uses] Vitamin (enzyme cofactor).
[Definition] ChEBI: A member of the class of pantothenic acids that is an amide formed from pantoic acid and beta-alanine.
[in vivo] (±)-Pantothenic acid (3 × 200 mg/kg; IP, single dosage) blocks VPA-induced decreases in c-Myb and Pim-1 protein expression; reduces the incidence of NTD to 6.8% in VPA-injected CD-1 mice, while incidence of the untreated group is 23.6%^[1].

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