Determine the necessary mass, volume, or concentration for preparing a solution.
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analytical standard Analytical standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C,Argon charged Ships Wet ice Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 6 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Vitamin B5 or pantothenic acid is a viscous oil that is soluble in ethanol and water. It is produced by plants and microorganisms.d-(+)pantothenic acid is the naturally occurring form of pantothenic acid and is biologically active.
Vitamin B-5D-Pantothenic acid calcium salt hydrate acts as a precursor in the biosynthesis of coenzyme A. It also involved in the catabolism of fatty acids, preparation of heme and the neurotransmitter acetylcholine. It is involved in the regulation of gene expression and in signal transduction. Further, it is used in sphingolipids, cholesterol and steroid hormones.
| Pubchem Sid | 488189813 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488189813 |
| Canonical Smiles | CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.[Ca+2] |
| IUPAC Name | calcium;3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoate |
| InChIKey | FAPWYRCQGJNNSJ-UBKPKTQASA-L |
| INCHI | 1S/2C9H17NO5.Ca/c2*1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;/h2*7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);/q;;+2/p-2/t2*7-;/m00./s1 |
| Isomeric SMILES | CC(C)(CO)[C@H](C(=O)NCCC(=O)[O-])O.CC(C)(CO)[C@H](C(=O)NCCC(=O)[O-])O.[Ca+2] |
| RTECS | RU4375000 |
| Molecular Weight | 476.54 |
| Beilstein | 4(3)1286 |
| Reaxy-Rn | 4049460 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4049460&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic acids and derivatives |
| Class | Carboxylic acids and derivatives |
| Subclass | Amino acids, peptides, and analogues |
| Intermediate Tree Nodes | Amino acids and derivatives |
| Direct Parent | Beta amino acids and derivatives |
| Alternative Parents | N-acyl amines Monosaccharides Secondary carboxylic acid amides Secondary alcohols Carboxylic acid salts Organic calcium salts Monocarboxylic acids and derivatives Carboxylic acids Primary alcohols Organopnictogen compounds Organonitrogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Not available |
| Substituents | Beta amino acid or derivatives - Fatty amide - Monosaccharide - N-acyl-amine - Fatty acyl - Carboxamide group - Carboxylic acid salt - Secondary alcohol - Secondary carboxylic acid amide - Carboxylic acid - Organic calcium salt - Monocarboxylic acid or derivatives - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Alcohol - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Primary alcohol - Organic salt - Organic zwitterion - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom. |
| External Descriptors | Not available |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Jun 07, 2023 | C293043 | |
| Certificate of Analysis | Jun 07, 2023 | C293043 | |
| Certificate of Analysis | Jun 07, 2023 | C293043 | |
| Certificate of Analysis | Jun 07, 2023 | C293043 | |
| Certificate of Analysis | Jun 07, 2023 | C293043 | |
| Certificate of Analysis | Jun 07, 2023 | C293043 | |
| Certificate of Analysis | Jun 07, 2023 | C293043 | |
| Certificate of Analysis | Jun 07, 2023 | C293043 | |
| Certificate of Analysis | Jun 07, 2023 | C293043 |
| Sensitivity | Moisture sensitive;Air sensitive;Light sensitive |
|---|---|
| Specific Rotation[α] | 27 ° (C=5, H2O) |
| Melt Point(°C) | 195-196°C |
| Molecular Weight | 476.500 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 10 |
| Exact Mass | 476.168 Da |
| Monoisotopic Mass | 476.168 Da |
| Topological Polar Surface Area | 219.000 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 233.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 3 |
| 1. Weng Chunyue, Mi Zheyan, Li Meijing, Qin Haibin, Hu Zhongce, Liu Zhiqiang, Zheng Yuguo, Wang Yuanshan. (2022) Improvement of S-adenosyl-L-methionine production in Saccharomyces cerevisiae by atmospheric and room temperature plasma-ultraviolet compound mutagenesis and droplet microfluidic adaptive evolution. 3 Biotech, 12 (9): (1-15). [PMID:35975026] [10.1007/s13205-022-03297-x] |
| 2. Naymul Karim, Mohammad Rezaul Islam Shishir, Tao Bao, Wei Chen. (2021) Effect of cold plasma pretreated hot-air drying on the physicochemical characteristics, nutritional values and antioxidant activity of shiitake mushroom. JOURNAL OF THE SCIENCE OF FOOD AND AGRICULTURE, 101 (15): (6271-6280). [PMID:33949697] [10.1002/jsfa.11296] |
| 3. Naiyi Yin, Zeliang Han, Huili Du, Pengfei Wang, Yunpeng Li, Xiaochen Chen, Guoxin Sun, Yanshan Cui, Zhengyi Hu. (2020) Effect of dietary vitamins in oral bioaccessibility of lead in contaminated soils based on the physiologically based extraction test. SCIENCE OF THE TOTAL ENVIRONMENT, [PMID:32791414] [10.1016/j.scitotenv.2020.141299] |
| 4. Zhuo Wang, Weixiao Nan, Huazhe Si, Shiyong Wang, Haihua Zhang, Guangyu Li. (2020) Pantothenic acid promotes dermal papilla cell proliferation in hair follicles of American minks via inhibitor of DNA Binding 3/Notch signaling pathway. LIFE SCIENCES, [PMID:32304761] [10.1016/j.lfs.2020.117667] |
| 5. Kangyuan Qu, Siyuan Xiong, Caiqian Huang, Xiaoxia Jiang, Lixia Tian, Shiwei Xie. (2024) Dietary supplementation of ornithine improved the growth, immune response and acute NH3 stress tolerance of Pacific white shrimp, Penaeus vannamei. Aquaculture Reports, [PMID:] [10.1016/j.aqrep.2024.102095] |
| 6. Haolin Zhang, Jingjing Zhang, Hui Cao, Petra Högger, Randolph Arroo, Mohamed A. Farag, Avi Shpigelman, Jianbo Xiao, Chunlin Li. (2025) Amination of Flavonoids Possessing a Pyrogallol Group in Cell Culture Medium at 37°C. Food Frontiers, 6 (2): (1058-1078). [PMID:] [10.1002/fft2.70002] |
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