产品名称：
(2R,3S)-beta-methylmalyl-CoA
其他名称： (2R,3S)-beta-methylmalyl-CoA；erythro-beta-methylmalyl-CoA
其他名称： (2R,3S)-beta-methylmalyl-CoA；erythro-beta-methylmalyl-CoA
结构信息
| 分子式 | C26H37N7O20P3S-5 | 分子量 | 892.6 | ||
| IUPAC Name | (2S,3R)-4-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonatooxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-2-hydroxy-3-methyl-4-oxobutanoate | ||||
| InChIKey | OTENCPQKSBPYCM-GQCNFOOOSA-I | ||||
| InChI | InChI=1S/C26H42N7O20P3S/c1-12(16(35)24(39)40)25(41)57-7-6-28-14(34)4-5-29-22(38)19(37)26(2,3)9-50-56(47,48)53-55(45,46)49-8-13-18(52-54(42,43)44)17(36)23(51-13)33-11-32-15-20(27)30-10-31-21(15)33/h10-13,16-19,23,35-37H,4-9H2,1-3H3,(H,28,34)(H,29,38)(H,39,40)(H,45,46)(H,47,48)(H2,27,30,31)(H2,42,43,44)/p-5/t12-,13-,16+,17-,18-,19+,23-/m1/s1 | ||||
| SMILES | CC(C(C(=O)[O-])O)C(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)([O-])[O-])O | ||||
