产品名称:
Malonyl-CoA,tetralithiumsalt
其他名称: 丙二酰辅酶A四锂盐;Coenzyme A, S-(hydrogenpropanedioate), tetralithium salt
CAS:116928-84-8
其他名称: 丙二酰辅酶A四锂盐;Coenzyme A, S-(hydrogenpropanedioate), tetralithium salt
CAS:116928-84-8
结构信息
分子式 | C24H34N7O19P3S-4.4[LI+] | 分子量 | 877.31 | ||
IUPAC Name | tetralithium;[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-[2-(2-carboxyacetyl)sulfanylethylamino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] phosphate | ||||
InChIKey | DQLXXYMNINXQSV-QTRRCMKVSA-J | ||||
InChI | InChI=1S/C24H38N7O19P3S.4Li/c1-24(2,19(37)22(38)27-4-3-13(32)26-5-6-54-15(35)7-14(33)34)9-47-53(44,45)50-52(42,43)46-8-12-18(49-51(39,40)41)17(36)23(48-12)31-11-30-16-20(25)28-10-29-21(16)31;;;;/h10-12,17-19,23,36-37H,3-9H2,1-2H3,(H,26,32)(H,27,38)(H,33,34)(H,42,43)(H,44,45)(H2,25,28,29)(H2,39,40,41);;;;/q;4*+1/p-4/t12-,17-,18-,19+,23-;;;;/m1..../s1 | ||||
SMILES | [Li+].[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)NCCSC(=O)CC(=O)O)O |