Basic Information |
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Product Name: | CIS-9-TETRADECENOYL COENZYME A |
CAS: | 87935-97-5 |
English Synonyms: | MYRISTOLEOYL COENZYME A ; CIS-9-TETRADECENOYL COENZYME A |
MDL Number.: | MFCD00079459 |
H bond acceptor: | 24 |
H bond donor: | 9 |
Smile: | CCCC/C=C\CCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(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/C35H60N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-26(44)63-19-18-37-25(43)16-17-38-33(47)30(46)35(2,3)21-56-62(53,54)59-61(51,52)55-20-24-29(58-60(48,49)50)28(45)34(57-24)42-23-41-27-31(36)39-22-40-32(27)42/h7-8,22-24,28-30,34,45-46H,4-6,9-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/b8-7-/t24-,28-,29-,30?,34-/m1/s1 |
InChiKey: | InChIKey=GIIFECKTWKZXGU-FHIGJDMPSA-N |
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