4-(2'-Carboxyphenyl)-4-Oxobutyryl-Coenzyme A Ester
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Product Description
Product
4-(2'-Carboxyphenyl)-4-Oxobutyryl-Coenzyme A Ester
CAS
97226-61-4
Synonym
4-(2'-carboxyphenyl)-4-oxobutyryl-coenzyme A ester; Coenzyme A, 4-(2'-carboxyphenyl)-4-oxobutyrate-; Cpo-coa ester; 4-(2'-Carboxyphenyl)-4-oxobutyryl-coa ester
Typical Product Specifications
SMILES
O=[P@@](O[P@@](OC[C@@H]1[C@@H](OP(O)(=O)O)[C@@H]([C@@H](n2cnc3c(ncnc23)N)O1)O)(=O)O)(OCC([C@@H](O)C(NCCC(NCCSC(CCC(c1c(cccc1)C(=O)O)=O)=O)=O)=O)(C)C)O
InChI
KVAQAPQXOXTRAE-UHFFFAOYSA-N
InChIKey
1S/C32H44N7O20P3S/c1-32(2,26(44)29(45)35-10-9-21(41)34-11-12-63-22(42)8-7-19(40)17-5-3-4-6-18(17)31(46)47)14-56-62(53,54)59-61(51,52)55-13-20-25(58-60(48,49)50)24(43)30(57-20)39-16-38-23-27(33)36-15-37-28(23)39/h3-6,15-16,20,24-26,30,43-44H,7-14H2,1-
Class
4-(2'-Carboxyphenyl)-4-Oxobutyryl-Coenzyme A Ester
Product Description
Product
4-(2'-Carboxyphenyl)-4-Oxobutyryl-Coenzyme A Ester
CAS
97226-61-4
Synonym
4-(2'-carboxyphenyl)-4-oxobutyryl-coenzyme A ester; Coenzyme A, 4-(2'-carboxyphenyl)-4-oxobutyrate-; Cpo-coa ester; 4-(2'-Carboxyphenyl)-4-oxobutyryl-coa ester
Typical Product Specifications
SMILES
O=[P@@](O[P@@](OC[C@@H]1[C@@H](OP(O)(=O)O)[C@@H]([C@@H](n2cnc3c(ncnc23)N)O1)O)(=O)O)(OCC([C@@H](O)C(NCCC(NCCSC(CCC(c1c(cccc1)C(=O)O)=O)=O)=O)=O)(C)C)O
InChI
KVAQAPQXOXTRAE-UHFFFAOYSA-N
InChIKey
1S/C32H44N7O20P3S/c1-32(2,26(44)29(45)35-10-9-21(41)34-11-12-63-22(42)8-7-19(40)17-5-3-4-6-18(17)31(46)47)14-56-62(53,54)59-61(51,52)55-13-20-25(58-60(48,49)50)24(43)30(57-20)39-16-38-23-27(33)36-15-37-28(23)39/h3-6,15-16,20,24-26,30,43-44H,7-14H2,1-
Class
