产品名称:
2-(2-Naphthylmethyl)succinyl-CoA
其他名称: Naphthyl-2-methyl-succinyl-CoA;S-[2-(2-Naphthylmethyl)-4-hydroxy-4-oxobutyryl]coenzyme A
CAS:830357-87-4
其他名称: Naphthyl-2-methyl-succinyl-CoA;S-[2-(2-Naphthylmethyl)-4-hydroxy-4-oxobutyryl]coenzyme A
CAS:830357-87-4
结构信息
分子式 | C36H48N7O19P3S | 分子量 | 1007.79 | ||
IUPAC Name | 4-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-3-(naphthalen-2-ylmethyl)-4-oxobutanoic acid | ||||
InChIKey | BLFNYMNSRZKVBB-JIFARLPCSA-N | ||||
InChI | InChI=1S/C36H48N7O19P3S/c1-36(2,30(48)33(49)39-10-9-25(44)38-11-12-66-35(50)23(15-26(45)46)14-20-7-8-21-5-3-4-6-22(21)13-20)17-59-65(56,57)62-64(54,55)58-16-24-29(61-63(51,52)53)28(47)34(60-24)43-19-42-27-31(37)40-18-41-32(27)43/h3-8,13,18-19,23-24,28-30,34,47-48H,9-12,14-17H2,1-2H3,(H,38,44)(H,39,49)(H,45,46)(H,54,55)(H,56,57)(H2,37,40,41)(H2,51,52,53)/t23?,24-,28-,29-,30+,34-/m1/s1 | ||||
SMILES | 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)C(CC4=CC5=CC=CC=C5C=C4)CC(=O)O)O |