产品名称：
3-dehydrocarnityl CoA
其他名称： 3-dehydrocarnityl CoA；3-dehydrocarnityl coenzyme A；CHEBI:85886；Q27158767
其他名称： 3-dehydrocarnityl CoA；3-dehydrocarnityl coenzyme A；CHEBI:85886；Q27158767
结构信息
| 分子式 | C28H48N8O18P3S+ | 分子量 | 909.7 | ||
| 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]-2,4-dioxobutyl]-trimethylazanium | ||||
| InChIKey | QNOIWONXQXNHSB-SVHODSNWSA-O | ||||
| InChI | InChI=1S/C28H47N8O18P3S/c1-28(2,23(41)26(42)31-7-6-18(38)30-8-9-58-19(39)10-16(37)11-36(3,4)5)13-51-57(48,49)54-56(46,47)50-12-17-22(53-55(43,44)45)21(40)27(52-17)35-15-34-20-24(29)32-14-33-25(20)35/h14-15,17,21-23,27,40-41H,6-13H2,1-5H3,(H7-,29,30,31,32,33,38,42,43,44,45,46,47,48,49)/p+1/t17-,21-,22-,23+,27-/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)CC(=O)C[N+](C)(C)C)O | ||||
