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CAS RN 18439-24-2

LiLiLiH3CCH3OPOOOPOOO(R)O(R)(R)OH(S)OPHOOONNH2NNN(R)OHONHONHSH

CAS RN 18439-24-2

IUPAC Name: trilithium(1+) (3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propyl ({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3-(hydrogen phosphonatooxy)-4-hydroxyoxolan-2-yl]methyl phosphonato}oxy)phosphonate
Synonyms: trilithium(1+) (3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propyl {[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3-(hydrogen phosphonatooxy)-4-hydroxyoxolan-2-yl]methyl phosphonato}oxyphosphonate
Molecular Weight (g/mol): 785.33
Molecular Formula: C21H33Li3N7O16P3S
InChi Key: QSCBPHBAFBVXRK-FFKZSOHASA-K
SMILES: [Li+].[Li+].[Li+].CC(C)(COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)([O-])=O)N1C=NC2=C(N)N=CN=C12)[C@@H](O)C(=O)NCCC(=O)NCCS
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Coenzyme A trilithium salt, 95%

EDGE
2

Coenzyme A Trilithium Salt Dihydrate ≥96%, White Crystalline Powder, MP Biomedicals™

CAS: 18439-24-2 Molecular Formula: C21H33Li3N7O16P3S Molecular Weight (g/mol): 785.329 MDL Number: MFCD00075848 InChI Key: QSCBPHBAFBVXRK-UHFFFAOYSA-K Synonym: coenzyme a, trilithium salt PubChem CID: 53442190 IUPAC Name: trilithium;[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 SMILES: [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCS)O

PubChem CID 53442190
CAS 18439-24-2
Molecular Weight (g/mol) 785.329
MDL Number MFCD00075848
SMILES [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCS)O
Synonym coenzyme a, trilithium salt
IUPAC Name trilithium;[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
InChI Key QSCBPHBAFBVXRK-UHFFFAOYSA-K
Molecular Formula C21H33Li3N7O16P3S
4

Coenzyme A Trilithium Salt, TRC

CAS: 18439-24-2 Molecular Formula: C21 H33 N7 O16 P3 S . 3 Li Molecular Weight (g/mol): 785.33 Synonym: CoA Trilithium Salt,Trilithium Coenzyme A; 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 SMILES: [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(=O)(O)[O-])n2cnc3c(N)ncnc23)C(O)C(=O)NCCC(=O)NCCS

CAS 18439-24-2
Molecular Weight (g/mol) 785.33
SMILES [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(=O)(O)[O-])n2cnc3c(N)ncnc23)C(O)C(=O)NCCC(=O)NCCS
Synonym CoA Trilithium Salt,Trilithium Coenzyme A;
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
Molecular Formula C21 H33 N7 O16 P3 S . 3 Li
5

Coenzyme A Trilithium Salt Dihydrate, 96%, Fisher BioReagents

CAS: 18439-24-2 Molecular Formula: C21H33Li3N7O16P3S Molecular Weight (g/mol): 785.329 InChI Key: QSCBPHBAFBVXRK-UHFFFAOYSA-K Synonym: coenzyme a, trilithium salt PubChem CID: 53442190 IUPAC Name: trilithium;[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 SMILES: [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCS)O

PubChem CID 53442190
CAS 18439-24-2
Molecular Weight (g/mol) 785.329
SMILES [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCS)O
Synonym coenzyme a, trilithium salt
IUPAC Name trilithium;[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
InChI Key QSCBPHBAFBVXRK-UHFFFAOYSA-K
Molecular Formula C21H33Li3N7O16P3S
6

Coenzyme A Trilithium Salt Dihydrate

CAS: 18439-24-2 Molecular Formula: C21H33Li3N7O16P3S Molecular Weight (g/mol): 785.329 MDL Number: MFCD00075848 InChI Key: QSCBPHBAFBVXRK-UHFFFAOYSA-K Synonym: coenzyme a, trilithium salt PubChem CID: 53442190 IUPAC Name: trilithium;[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 SMILES: [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCS)O

PubChem CID 53442190
CAS 18439-24-2
Molecular Weight (g/mol) 785.329
MDL Number MFCD00075848
SMILES [Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)[O-])C(C(=O)NCCC(=O)NCCS)O
Synonym coenzyme a, trilithium salt
IUPAC Name trilithium;[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
InChI Key QSCBPHBAFBVXRK-UHFFFAOYSA-K
Molecular Formula C21H33Li3N7O16P3S