CIS-15-TETRACOSENOYL COENZYME A

CAS No.
88362-35-0
CCD No.
CCD08008822
Formula
C45 H80 N7 O17 P3 S
MolWeight
1116.15

Basic Information

Product Name: CIS-15-TETRACOSENOYL COENZYME A
CAS: 88362-35-0
English Synonyms: NERVONOYL COENZYME A ; CIS-15-TETRACOSENOYL COENZYME A
MDL Number.: MFCD00079509
H bond acceptor: 24
H bond donor: 9
Smile: CCCCCCCC/C=C\CCCCCCCCCCCCCC(=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/C45H80N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-36(54)73-29-28-47-35(53)26-27-48-43(57)40(56)45(2,3)31-66-72(63,64)69-71(61,62)65-30-34-39(68-70(58,59)60)38(55)44(67-34)52-33-51-37-41(46)49-32-50-42(37)52/h11-12,32-34,38-40,44,55-56H,4-10,13-31H2,1-3H3,(H,47,53)(H,48,57)(H,61,62)(H,63,64)(H2,46,49,50)(H2,58,59,60)/b12-11-/t34-,38-,39-,40?,44-/m1/s1
InChiKey: InChIKey=QHZAQVTVYPHLKK-SQFVTABDSA-N

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