Products for Research Use Only
RegisterLogin

Coenzyme A, Trilithium salt

CAT: 1573-A-03-50MGSize: 1 PCDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1573-A-03-50MGSize:1 PC
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
18439-24-2
Synonyms
CoA trilithium salt, CoA Li3
Purity
≥ 98%
Smiles
SCCNC (CCNC (C (C (C) (COP ([O-]) (OP ([O-]) (OCC (C (C1O) OP (O) ([O-]) =O) OC1N (C2=NC=N3) C=NC2=C3N) =O) =O) C) O) =O) =O.[Li+].[Li+].[Li+]
Molecular Formula
C21H33N7O16P3S · 3Li
Molecular Weight
767.53 g/mol (free acid basis)
Shipping Conditions
Ambient temperature (styrofoam + ice gels)
Storage Conditions
-20°C
Package Size
50mg
Notes
Research Use Only

Chemical Information

coenzyme a, trilithium salt
CAS Number18439-24-2
PubChem CID87641
IUPAC Nametrilithium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-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
Molecular FormulaC21H33Li3N7O16P3S
Molecular Weight785.4
Topological Polar Surface Area356
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count21
Rotatable Bond Count18
Heavy Atom Count51
Formal Charge0
Complexity1250
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@H](C(=O)NCCC(=O)NCCS)O
InChI
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
InChIKey
QSCBPHBAFBVXRK-FFKZSOHASA-K
Chemical Structure
2D Structure
2D structure of coenzyme a, trilithium salt
CAS: 18439-24-2
CID: 87641
Formula: C21H33Li3N7O16P3S
MW: 785.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight785.4
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count21
Rotatable Bond Count18
Exact Mass785.1397455
Monoisotopic Mass785.1397455
Topological Polar Surface Area356 Ų
Heavy Atom Count51
Formal Charge0
Complexity1250
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count4
Compound Is CanonicalizedYes

Related Products

CatalogName
A-17-50MGCoenzyme A, Sodium salt
A-17-25MGCoenzyme A, Sodium salt
A-17-10MGCoenzyme A, Sodium salt
A-17-100MGCoenzyme A, Sodium salt
A-49-25MGPhenylacetyl Coenzyme A, Sodium salt
A-40-25MGMethylmalonyl Coenzyme A, Sodium salt
A-37-10MGSuccinyl Coenzyme A, Sodium salt
A-34-10MGGlutaryl Coenzyme A, Sodium salt
A-33-10MGGlutaryl Coenzyme A, Lithium salt
A-31-10MGMalonyl Coenzyme A, Sodium salt

Alternative Products

CatalogName
sc-203901CCoenzyme A, Trilithium Salt
TRC-C636400-1GCoenzyme A Trilithium Salt
MBS170425Coenzyme A (CoA), Trilithium Salt
sc-214465Acetyl coenzyme A trilithium salt
BIA1091Acetyl-Coenzyme A Trilithium Salt
GTR19240641-01Acetyl Coenzyme A, Trilithium salt
sc-215148Hexanoyl coenzyme A trilithium salt
sc-300396ACrotonoyl coenzyme A trilithium salt
236938-01Coenzyme A trilithium salt 98+%
MBS682017Coenzyme A, Trilithium Salt (CoA-Li)

Popular Products