Products for Research Use Only
RegisterLogin

Coenzyme A

CAT: 0013-GTR19157783-05Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19157783-05Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Coenzyme A is an obligatory cofactor in all living cells synthesized from pantothenate (Vitamin B5), adenosine triphosphate (ATP), and cysteine.Covalent binding of Coenzyme A to Peroxiredoxin 5 (Prdx5) results in complete inhibition of its peroxidase activity, which is reversed by reduction with DTT. Many human pathologies, including cancer, diabetes, and neurodegeneration, have been associated with abnormal biosynthesis and homeostasis of CoA and its derivatives.
CAS Number
85-61-0
Purity
>98% (HPLC)
Solubility
In Vitro: H2O : 125 mg/mL (162.86 mM)
Smiles
CC (C) (COP (O) (=O) OP (O) (=O) OC[C@H]1O[C@H] ([C@H] (O) [C@@H]1OP (O) (O) =O) n1cnc2c (N) ncnc12) [C@@H] (O) C (=O) NCCC (=O) NCCS
Molecular Formula
C21H36N7O16P3S
Molecular Weight
767.53
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Coenzyme A

Coenzyme A is a thiol comprising a panthothenate unit in phosphoric anhydride linkage with a 3',5'-adenosine diphosphate unit; and an aminoethanethiol unit. It has a role as a coenzyme, a mouse metabolite and an Escherichia coli metabolite. It is a secondary carboxamide, a member of 6-aminopurines, a nucleotide derivative and a thiol. It is functionally related to a 3'-phosphate-adenosine-5'-diphosphate. It is a conjugate acid of a coenzyme A(4-).

CAS Number85-61-0
PubChem CID87642
IUPAC Name[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-sulfanylethylamino)propyl]amino]butyl] hydrogen phosphate
Molecular FormulaC21H36N7O16P3S
Molecular Weight767.5
XLogP-5.8
Topological Polar Surface Area348
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count21
Rotatable Bond Count18
Heavy Atom Count48
Formal Charge0
Complexity1270
SMILES
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@H](C(=O)NCCC(=O)NCCS)O
InChI
InChI=1S/C21H36N7O16P3S/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)/t11-,14-,15-,16+,20-/m1/s1
InChIKey
RGJOEKWQDUBAIZ-IBOSZNHHSA-N
Chemical Structure
2D Structure
2D structure of Coenzyme A
CAS: 85-61-0
CID: 87642
Formula: C21H36N7O16P3S
MW: 767.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight767.5
XLogP3-5.8
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count21
Rotatable Bond Count18
Exact Mass767.11521025
Monoisotopic Mass767.11521025
Topological Polar Surface Area348 Ų
Heavy Atom Count48
Formal Charge0
Complexity1270
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19266963-01Biotin-PEG3-CoenzymeA

Alternative Products

CatalogName
T10857-01Coenzyme A
TRC-C636510-100MGCoenzyme Q11
B8229-5Methylmalonyl Coenzyme A
HY-E70523Pentanoyl coenzyme A
FD65841-01Coenzyme B12
NN47201-01Nonadecanoyl coenzyme A
NM47200-01Myristoyl coenzyme A
NB63246-01Biotinyl coenzyme A
HY-128851A-01Coenzyme A (trilithium)
HY-137868Decanoyl coenzyme A

Popular Products