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Ganirelix Acetate Impurity D

SZ CAT No SZ-G029005
CAS No 129225-21-4
Mol.F. C80H112ClN17O14
Mol.Wt. 1571.3
Inv. Status Custom Synthesis


Chemical Name: N2-N2-((R)-2-((R)-2-((R)-2-Acetamido-3-(naphthalen-2-yl)propanamido)-3-(4-chlorophenyl)propanamido)-3-(pyridin-3-yl)propanoyl)-L-seryl-L-tyrosyl-N6-((E)-N,N'-diethylcarbamimidoyl)-D-lysyl-L-leucyl-N6-((E)-N,N'-diethylcarbamimidoyl)-L-lysyl-L-prolyl-D-alanine

Smiles: CC(N[C@H](CC1=CC=C(C=CC=C2)C2=C1)C(N[C@H](CC3=CC=C(Cl)C=C3)C(N[C@H](CC4=CC=CN=C4)C(N[C@@H](CO)C(N[C@@H](CC5=CC=C(O)C=C5)C(N[C@H](CCCCN/C(NCC)=N/CC)C(N[C@@H](CC(C)C)C(N[C@@H](CCCCN/C(NCC)=N/CC)C(N6CCC[C@H]6C(N[C@H](C)C(O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O

Inchi: InChI=1S/C80H113ClN18O13/c1-9-84-79(85-10-2)88-38-17-15-24-60(70(104)94-62(41-49(5)6)71(105)93-61(25-16-18-39-89-80(86-11-3)87-12-4)78(112)99-40-20-26-68(99)77(111)90-50(7)69(82)103)92-73(107)64(44-53-30-35-59(102)36-31-53)97-76(110)67(48-100)98-75(109)66(46-55-21-19-37-83-47-55)96-74(108)65(43-52-28-33-58(81)34-29-52)95-72(106)63(91-51(8)101)45-54-27-32-56-22-13-14-23-57(56)42-54/h13-14,19,21-23,27-37,42,47,49-50,60-68,100,102H,9-12,15-18,20,24-26,38-41,43-46,48H2,1-8H3,(H2,82,103)(H,90,111)(H,91,101)(H,92,107)(H,93,105)(H,94,104)(H,95,106)(H,96,108)(H,97,110)(H,98,109)(H2,84,85,88)(H2,86,87,89)/t50-,60-,61+,62+,63-,64+,65-,66-,67-,68+/m1/s1