D-Pantothenic acid hemicalcium salt - BioReagent, for cell culture, for insect cell culture, for plant cell culture , CAS No.137-08-6

CAS: 137-08-6 Cat. No.: D431996 Peso molecular: 476.54 Beilstein Registry Number: 4(3)1286 Número EC: 205-278-9

GRADE & PURITY BioReagent, for Cell culture, Suitable for insect cell culture, Suitable for plant cell culture

Synonyms

Monocalcium bis(3-((2R)-2,4-dihydroxy-3,3-dimethylbutanoylamino)propanoate) | NCGC00014494-02 | D03AX04 | NSC 36292 | Pantotenato calcico | Q5458164 | UNII-568ET80C3D | (2E)-3-Phenyl-2-propenyl formate # | CALCIUM PANTOTHENATE [WHO-DD] | Dextro calcium pa

Storage

Store at 2-8°C

Shipped In

Wet ice

Descripción general

Plants and microorganisms, such as Escherichia coli are the major sources of D-pantothenic acid. It is water soluble and quite stable to heating.

Application

D-Pantothenic acid hemicalcium salt has been used: as a component of FMX-turbodoma- derived media as a supplement in DMEM (Dulbecco′s modified eagle media)/F-12 used for cell proliferation as a supplement in preadipocyte media Precursor in the biosynthesis of coenzyme A.

Specifications

Sinónimos

Monocalcium bis(3-((2R)-2, 4-dihydroxy-3, 3-dimethylbutanoylamino)propanoate) | NCGC00014494-02 | D03AX04 | NSC 36292 | Pantotenato calcico | Q5458164 | UNII-568ET80C3D | (2E)-3-Phenyl-2-propenyl formate # | CALCIUM PANTOTHENATE [WHO-DD] | Dextro calcium pa

Especificaciones y pureza

BioReagent, for cell culture, for insect cell culture, for plant cell culture

Mecanismos bioquímicos y fisiológicos

Along with coenzyme A (CoA, D-pantothenic acid is a precursor for acyl carrier protein. These are essential cofactors involved in fat, protein and carbohydrate metabolism. It also participates in the formation of acetylcholine neurotransmitter. D-pantothe

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Grado

BioReagent, for Cell culture, Suitable for insect cell culture, Suitable for plant cell culture

Tipo de acción

INHIBITOR

Nombres e identificadores

• Pubchem Sid: 504758809
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504758809
• Sonrisas canónicas: 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
• Isómeros 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
• Peso molecular: 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=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Beta amino acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: 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
• Descripción: 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

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Objetivos asociados (humanos)

F2 Tclin Thrombin (11687 Activities)

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ESR1 Tclin Estrogen receptor alpha (17718 Activities)

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PGR Tclin Progesterone receptor (8562 Activities)

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ADRB2 Tclin Beta-2 adrenergic receptor (11824 Activities)

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CHRM2 Tclin Muscarinic acetylcholine receptor M2 (10671 Activities)

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HTR1A Tclin Serotonin 1a (5-HT1a) receptor (14969 Activities)

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ADRA2A Tclin Alpha-2a adrenergic receptor (9450 Activities)

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AR Tclin Androgen Receptor (11781 Activities)

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CHRM1 Tclin Muscarinic acetylcholine receptor M1 (12690 Activities)

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DRD2 Tclin Dopamine D2 receptor (23596 Activities)

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GABRA1 Tclin GABA receptor alpha-1 subunit (399 Activities)

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MAOA Tclin Monoamine oxidase A (11911 Activities)

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CNR1 Tclin Cannabinoid CB1 receptor (20913 Activities)

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DRD1 Tclin Dopamine D1 receptor (9720 Activities)

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ACHE Tclin Acetylcholinesterase (18204 Activities)

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PTGS1 Tclin Cyclooxygenase-1 (9233 Activities)

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SLC6A2 Tclin Norepinephrine transporter (10102 Activities)

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HRH2 Tclin Histamine H2 receptor (5428 Activities)

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HTR2A Tclin Serotonin 2a (5-HT2a) receptor (14758 Activities)

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HTR2C Tclin Serotonin 2c (5-HT2c) receptor (11471 Activities)

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ADORA1 Tclin Adenosine A1 receptor (17603 Activities)

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SLC6A4 Tclin Serotonin transporter (12625 Activities)

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ADRA1A Tclin Alpha-1a adrenergic receptor (8359 Activities)

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OPRM1 Tclin Mu opioid receptor (19785 Activities)

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DRD3 Tclin Dopamine D3 receptor (14368 Activities)

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OPRD1 Tclin Delta opioid receptor (15096 Activities)

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OPRK1 Tclin Kappa opioid receptor (16155 Activities)

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HTR3A Tclin Serotonin 3a (5-HT3a) receptor (3366 Activities)

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SLC6A3 Tclin Dopamine transporter (10535 Activities)

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GRIN1 Tclin Glutamate (NMDA) receptor subunit zeta 1 (122 Activities)

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KCNH2 Tclin HERG (29587 Activities)

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PDE3A Tclin Phosphodiesterase 3A (3309 Activities)

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ADRA2B Tclin Alpha-2b adrenergic receptor (4412 Activities)

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ADRA2C Tclin Alpha-2c adrenergic receptor (4876 Activities)

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CHRM3 Tclin Muscarinic acetylcholine receptor M3 (7750 Activities)

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HTR2B Tclin Serotonin 2b (5-HT2b) receptor (10323 Activities)

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TBXA2R Tclin Thromboxane A2 receptor (5717 Activities)

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PDE4A Tclin Phosphodiesterase 4A (1943 Activities)

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HRH3 Tclin Histamine H3 receptor (10389 Activities)

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POLI Tchem DNA polymerase iota (116820 Activities)

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GMNN Tbio Geminin (128009 Activities)

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TARDBP Tchem TAR DNA-binding protein 43 (40113 Activities)

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Objetivos asociados (no humanos)

Pde4d Phosphodiesterase 4D (4 Activities)

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coaA Pantothenate kinase (64 Activities)

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Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: water: soluble 50mg/mL, clear, colorless
• Rotación específica [α]: 27 ° (C=5, H2O)
• Punto de fusión (°C): 195-196°C
• Peso molecular: 476.500 g/mol
• 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

XLogP3

Referencias

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]