Product Name:
cis-hexadec-7-enoyl-CoA
Other Names: (7Z)-hexadecenoyl-CoA(4-);cis-hexadec-7-enoyl-CoA;(7Z)-hexadec-7-enoyl-CoA;16:1 cis-7;cis-hexadec-7-enoyl-CoA(4-);CHEBI:87698;(7Z)-hexadecenoyl-coenzyme A(4-);cis-hexadec-7-enoyl-coenzyme A(4-);16:1(n-9);Q27159839
Other Names: (7Z)-hexadecenoyl-CoA(4-);cis-hexadec-7-enoyl-CoA;(7Z)-hexadec-7-enoyl-CoA;16:1 cis-7;cis-hexadec-7-enoyl-CoA(4-);CHEBI:87698;(7Z)-hexadecenoyl-coenzyme A(4-);cis-hexadec-7-enoyl-coenzyme A(4-);16:1(n-9);Q27159839
Structural Information
Molecular Formula | C37H60N7O17P3S-4 | Molecular Weight | 999.9 | ||
IUPAC Name | [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-[2-[(Z)-hexadec-7-enoyl]sulfanylethylamino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] phosphate | ||||
InChIKey | MJWMOLDKMBISOB-YDGGZUKGSA-J | ||||
InChI | InChI=1S/C37H64N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(46)65-21-20-39-27(45)18-19-40-35(49)32(48)37(2,3)23-58-64(55,56)61-63(53,54)57-22-26-31(60-62(50,51)52)30(47)36(59-26)44-25-43-29-33(38)41-24-42-34(29)44/h11-12,24-26,30-32,36,47-48H,4-10,13-23H2,1-3H3,(H,39,45)(H,40,49)(H,53,54)(H,55,56)(H2,38,41,42)(H2,50,51,52)/p-4/b12-11-/t26-,30-,31-,32+,36-/m1/s1 | ||||
SMILES | CCCCCCCCC=CCCCCCC(=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 |