Coenzyme A (lithium salt hydrate) - ≥95% , CAS No.18439-24-2

CAS: 18439-24-2 Cat. No.: C130755 Molecular Weight: 764.5（free basis） EC Number: 242-317-9

GRADE & PURITY ≥95%

Synonyms

Coenzyme A (lithium salt) | CoA | Coenzyme A trilithium salt | CoA Li3

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Overview

Coenzyme A (CoA) is synthesized from phosphopantothenate by the action of enzyme pantothenate kinase and is the master regulator. 

Specifications

Synonyms

Coenzyme A (lithium salt) | CoA | Coenzyme A trilithium salt | CoA Li3

Specifications & Purity

≥95%

Biochemical and Physiological Mechanisms

Coenzyme A (CoA, CoASH, HSCoA) is a coenzyme that promotes enzymatic acyl transfer reactions and supports fatty acid synthesis and oxidation. CoA participates in the mechanisms of action of various enzymes. Acyl CoA accumulation is related to metabolic di

Storage

Store at -20°C, Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥95%

Names and Identifiers

• Canonical Smiles: [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCS)O
• IUPAC Name: trilithium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-sulfanylethylamino)propyl]amino]butoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] hydrogen phosphate
• InChIKey: QSCBPHBAFBVXRK-HJKJOZROSA-K
• INCHI: 1S/C21H36N7O16P3S.3Li/c1-21(2,16(31)19(32)24-4-3-12(29)23-5-6-48)8-41-47(38,39)44-46(36,37)40-7-11-15(43-45(33,34)35)14(30)20(42-11)28-10-27-13-17(22)25-9-26-18(13)28;;;/h9-11,14-16,20,30-31,48H,3-8H2,1-2H3,(H,23,29)(H,24,32)(H,36,37)(H,38,39)(H2,22,25,26)(H2,33,34,35);;;/q;3*+1/p-3/t11-,14-,15-,16?,20-;;;/m1.../s1
• Isomeric SMILES: [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCS)O
• Molecular Weight: 764.5（free basis）
• Reaxy-Rn: 34715583
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=34715583&ln=

Chemical and Physical Properties

• Solubility: DMSO (Slightly, Heated), Water (Slightly)
• Sensitivity: Moisture sensitive
• Molecular Weight: 785.400 g/mol
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 21
• Rotatable Bond Count: 18
• Exact Mass: 785.14 Da
• Monoisotopic Mass: 785.14 Da
• Topological Polar Surface Area: 356.000 Ų
• Heavy Atom Count: 51
• Formal Charge: 0
• Complexity: 1250.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 4

XLogP3