产品名称:
2-Oxoglutaroyl-CoA
其他名称: 2-Oxoglutaryl-CoA;2-Oxoglutaroyl-CoA;SCHEMBL1408384;C20447;CID9548020; (Acyl-CoA); [M+H]+;
其他名称: 2-Oxoglutaryl-CoA;2-Oxoglutaroyl-CoA;SCHEMBL1408384;C20447;CID9548020; (Acyl-CoA); [M+H]+;
结构信息
分子式 | C26H40N7O20P3S | 分子量 | 895.6 | ||
IUPAC Name | 5-[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]-4,5-dioxopentanoic acid | ||||
InChIKey | QYHKIXYHXCJHTR-CITAKDKDSA-N | ||||
InChI | InChI=1S/C26H40N7O20P3S/c1-26(2,20(39)23(40)29-6-5-15(35)28-7-8-57-25(41)13(34)3-4-16(36)37)10-50-56(47,48)53-55(45,46)49-9-14-19(52-54(42,43)44)18(38)24(51-14)33-12-32-17-21(27)30-11-31-22(17)33/h11-12,14,18-20,24,38-39H,3-10H2,1-2H3,(H,28,35)(H,29,40)(H,36,37)(H,45,46)(H,47,48)(H2,27,30,31)(H2,42,43,44)/t14-,18-,19-,20+,24-/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(=O)CCC(=O)O)O |