产品名称:
12-hydroxydodecanoyl-CoA
其他名称: 12-hydroxydodecanoyl-CoA;12-hydroxylauroyl-CoA;omega-hydroxylauroyl-CoA;omega-hydroxydodecanoyl-CoA
其他名称: 12-hydroxydodecanoyl-CoA;12-hydroxylauroyl-CoA;omega-hydroxylauroyl-CoA;omega-hydroxydodecanoyl-CoA
结构信息
分子式 | C33H54N7O18P3S-4 | 分子量 | 961.8 | ||
IUPAC Name | [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-4-[[3-[2-(12-hydroxydodecanoylsulfanyl)ethylamino]-3-oxopropyl]amino]-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate | ||||
InChIKey | ZCRRHZUCLLDPCW-GMHMEAMDSA-J | ||||
InChI | InChI=1S/C33H58N7O18P3S/c1-33(2,28(45)31(46)36-14-13-23(42)35-15-17-62-24(43)12-10-8-6-4-3-5-7-9-11-16-41)19-55-61(52,53)58-60(50,51)54-18-22-27(57-59(47,48)49)26(44)32(56-22)40-21-39-25-29(34)37-20-38-30(25)40/h20-22,26-28,32,41,44-45H,3-19H2,1-2H3,(H,35,42)(H,36,46)(H,50,51)(H,52,53)(H2,34,37,38)(H2,47,48,49)/p-4/t22-,26-,27-,28+,32-/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)CCCCCCCCCCCO)O |