产品名称：
(S)-3-Hydroxyhexanoyl-CoA
其他名称： (S)-3-羟基己酰辅酶A;Coenzyme A, S-(3-hydroxyhexanoate), (S)-；L-3-Hydroxyhexanoyl-CoA
CAS：79171-47-4
其他名称： (S)-3-羟基己酰辅酶A;Coenzyme A, S-(3-hydroxyhexanoate), (S)-；L-3-Hydroxyhexanoyl-CoA
CAS：79171-47-4
结构信息
| 分子式 | C27H46N7O18P3S | 分子量 | 881.68 | ||
| IUPAC Name | S-[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]ethyl] (3S)-3-hydroxyhexanethioate | ||||
| InChIKey | VAAHKRMGOFIORX-IKTBLOROSA-N | ||||
| InChI | InChI=1S/C27H46N7O18P3S/c1-4-5-15(35)10-18(37)56-9-8-29-17(36)6-7-30-25(40)22(39)27(2,3)12-49-55(46,47)52-54(44,45)48-11-16-21(51-53(41,42)43)20(38)26(50-16)34-14-33-19-23(28)31-13-32-24(19)34/h13-16,20-22,26,35,38-39H,4-12H2,1-3H3,(H,29,36)(H,30,40)(H,44,45)(H,46,47)(H2,28,31,32)(H2,41,42,43)/t15-,16+,20+,21+,22-,26+/m0/s1 | ||||
| SMILES | CCCC(CC(=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)O | ||||
