Product Name：
2-methyl-3-oxopalmitoyl-CoA(4-)
Other Names： 2-methyl-3-oxopalmitoyl-CoA(4-)；3-oxo-2-methylhexadecanoyl-CoA；CHEBI:86042；3-keto-2-methylpalmitoyl-CoA(4-)；2-methyl-3-oxohexadecanoyl-CoA(4-)；3-keto-2-methylhexadecanoyl-CoA(4-)；3-keto-2-methylpalmitoyl-coenzyme A(4-)；2-methyl-3-oxohexadecanoyl-coenzyme A(4-)；3-keto-2-methylhexadecanoyl-coenzyme A(4-)；Q27158859
Other Names： 2-methyl-3-oxopalmitoyl-CoA(4-)；3-oxo-2-methylhexadecanoyl-CoA；CHEBI:86042；3-keto-2-methylpalmitoyl-CoA(4-)；2-methyl-3-oxohexadecanoyl-CoA(4-)；3-keto-2-methylhexadecanoyl-CoA(4-)；3-keto-2-methylpalmitoyl-coenzyme A(4-)；2-methyl-3-oxohexadecanoyl-coenzyme A(4-)；3-keto-2-methylhexadecanoyl-coenzyme A(4-)；Q27158859
Structural Information
| Molecular Formula | C38H62N7O18P3S-4 | Molecular Weight | 1029.9 | ||
| IUPAC Name | [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[[[(3R)-3-hydroxy-2,2-dimethyl-4-[[3-[2-(2-methyl-3-oxohexadecanoyl)sulfanylethylamino]-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate | ||||
| InChIKey | WUWKXNAGPVGNAF-PDKNGGRYSA-J | ||||
| InChI | InChI=1S/C38H66N7O18P3S/c1-5-6-7-8-9-10-11-12-13-14-15-16-26(46)25(2)37(51)67-20-19-40-28(47)17-18-41-35(50)32(49)38(3,4)22-60-66(57,58)63-65(55,56)59-21-27-31(62-64(52,53)54)30(48)36(61-27)45-24-44-29-33(39)42-23-43-34(29)45/h23-25,27,30-32,36,48-49H,5-22H2,1-4H3,(H,40,47)(H,41,50)(H,55,56)(H,57,58)(H2,39,42,43)(H2,52,53,54)/p-4/t25?,27-,30-,31-,32+,36-/m1/s1 | ||||
| SMILES | CCCCCCCCCCCCCC(=O)C(C)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 | ||||
