Compound Details

 Compound-ID 30605
 Common Name Pivalyl-CoA
 Synonyms 2,2-Dimethylpropanoyl-CoA
 InChI InChI=1S/C26H44N7O17P3S/c1-25(2,3)24(38)54-9-8-28-15(34)6-7-29-22(37)19(36)26(4,5)11-47-53(44,45)50-52(42,43)46-10-14-18(49-51(39,40)41)17(35)23(48-14)33-13-32-16-20(27)30-12-31-21(16)33/h12-14,17-19,23,35-36H,6-11H2,1-5H3,(H,28,34)(H,29,37)(H,42,43)(H,44,45)(H2,27,30,31)(H2,39,40,41)/p-4/t14-,17-,18-,19+,23-/m1/s1
 SMILES CC(C)(C)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)([O-])[O-])O
 External Links
 PUBCHEM-CID 126843492
 ChEBI-ID 137545
136712
 CHEMSPIDER-ID 7822294
 METACYC-ID CPD-19874
 METANETX-ID MNXM745042


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