basic_info |
|
| Product_Name: | NONADECANOYL COENZYME A |
| CAS: | 25045-61-8 |
| EnglishSynonyms: | NONADECANOYL COENZYME A |
| pro_mdlNumber: | MFCD02259059 |
| pro_acceptors: | 24 |
| pro_donors: | 9 |
| pro_smile: | CCCCCCCCCCCCCCCCCCC(=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)n2cnc3c2ncnc3N)O)OP(=O)(O)O)O |
| InChi: | InChI=1S/C40H72N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-31(49)68-24-23-42-30(48)21-22-43-38(52)35(51)40(2,3)26-61-67(58,59)64-66(56,57)60-25-29-34(63-65(53,54)55)33(50)39(62-29)47-28-46-32-36(41)44-27-45-37(32)47/h27-29,33-35,39,50-51H,4-26H2,1-3H3,(H,42,48)(H,43,52)(H,56,57)(H,58,59)(H2,41,44,45)(H2,53,54,55)/t29-,33-,34-,35+,39-/m1/s1 |
| InChiKey: | InChIKey=YUJZGRUJMWKAJF-ZOUGCNRJSA-N |
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