Molecule: (2S)-pristanoyl-CoA
Pristanoyl-CoA in which C-2 of the pristanoyl group has S-configuration.
Synonyms for (2S)-pristanoyl-CoA :
(2S)-2,6,10,14-tetramethylpentadecanoyl-CoA
(2S)-2,6,10,14-tetramethylpentadecanoyl-coenzyme A
(2S)-pristanoyl-coenzyme A
Molecular Formula: C40H72N7O17P3S
Molecular wt: 1048.02300 g/mole
Charge: 0
SMILES: CC(C)CCCC(C)CCCC(C)CCC[C@H](C)C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12
InChIKey: XYJPSQPVCBNZHT-DHBXAFLLSA-N
InChI=1S/C40H72N7O17P3S/c1-25(2)11-8-12-26(3)13-9-14-27(4)15-10-16-28(5)39(52)68-20-19-42-30(48)17-18-43-37(51)34(50)40(6,7)22-61-67(58,59)64-66(56,57)60-21-29-33(63-65(53,54)55)32(49)38(62-29)47-24-46-31-35(41)44-23-45-36(31)47/h23-29,32-34,38,49-50H,8-22H2,1-7H3,(H,42,48)(H,43,51)(H,56,57)(H,58,59)(H2,41,44,45)(H2,53,54,55)/t26?,27?,28-,29+,32+,33+,34-,38+/m0/s1