产品名称：
Heptadecanonyldethio-CoA
其他名称： Heptadecanonyldethio-coenzyme A
CAS：79250-89-8
其他名称： Heptadecanonyldethio-coenzyme A
CAS：79250-89-8
结构信息
| 分子式 | C38H68N7O17P3.3LI | 分子量 | 996.72 | ||
| IUPAC Name | trilithium;[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(3R)-4-[[3-(heptadecan-2-yloxymethylamino)-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl] hydrogen phosphate | ||||
| InChIKey | BJLZRPSDTGRCMT-LTZQTJBYSA-N | ||||
| InChI | InChI=1S/C37H68N7O17P3.3Li/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(2)56-25-43-28(45)19-20-39-35(48)32(47)37(3,4)22-58-64(54,55)61-63(52,53)57-21-27-31(60-62(49,50)51)30(46)36(59-27)44-24-42-29-33(38)40-23-41-34(29)44;;;/h23-24,26-27,30-32,36,46-47H,5-22,25H2,1-4H3,(H,39,48)(H,43,45)(H,52,53)(H,54,55)(H2,38,40,41)(H2,49,50,51);;;/q;3*+1/t26?,27-,30-,31-,32+,36-;;;/m1.../s1 | ||||
| SMILES | [Li+].[Li+].[Li+].CCCCCCCCCCCCCCCC(C)OCNC(=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 | ||||
