1-N-Ac-Trp-2-(4-Cl-Phe)-3-Trp-6-Phe-10-Alanh2-Lhrh
[CAS# 78493-59-1]

Identification

• Name: 1-N-Ac-Trp-2-(4-Cl-Phe)-3-Trp-6-Phe-10-Alanh2-Lhrh
• Synonyms: Atcppa-Lhrh; D-Alaninamide, N-Acetyl-D-Tryptophyl-4-Chloro-D-Phenylalanyl-D-Tryptophyl-L-Seryl-L-Tyrosyl-D-Phenylalanyl-L-Leucyl-L-Arginyl-L-Prolyl-; Gnrh, (N)-Ac-Trp(1)-(4-Cl-Phe)(2)-Trp(3)-Phe(6)-Alanh2(10)-
• Molecular Formula: C₇₄H₉₁ClN₁₆O₁₃
• Molecular Weight: 1448.09
• CAS Registry Number: 78493-59-1
• SMILES: [C@@H](C(=O)NC([C@H](NC(=O)C)CC1=C[NH]C2=CC=CC=C12)=O)(NC([C@H]3N(CCC3)C([C@@H](NC([C@@H](NC([C@H](NC([C@@H](NC([C@@H](NC([C@H](NC([C@H](N)CC4=CC=C(C=C4)Cl)=O)CC5=C[NH]C6=CC=CC=C56)=O)CO)=O)CC7=CC=C(O)C=C7)=O)CC8=CC=CC=C8)=O)CC(C)C)=O)CCCNC(=N)N)=O)=O)C
• InChI: 1S/C74H91ClN16O13/c1-41(2)32-57(66(97)84-56(20-12-30-79-74(77)78)73(104)91-31-13-21-63(91)72(103)82-42(3)64(95)90-70(101)60(83-43(4)93)36-47-38-80-54-18-10-8-16-51(47)54)86-67(98)58(34-44-14-6-5-7-15-44)87-68(99)59(35-46-24-28-50(94)29-25-46)88-71(102)62(40-92)89-69(100)61(37-48-39-81-55-19-11-9-17-52(48)55)85-65(96)53(76)33-45-22-26-49(75)27-23-45/h5-11,14-19,22-29,38-39,41-42,53,56-63,80-81,92,94H,12-13,20-21,30-37,40,76H2,1-4H3,(H,82,103)(H,83,93)(H,84,97)(H,85,96)(H,86,98)(H,87,99)(H,88,102)(H,89,100)(H4,77,78,79)(H,90,95,101)/t42-,53-,56+,57+,58-,59+,60-,61-,62+,63+/m1/s1
• InChIKey: LJWJYSNNBIRUFP-LYTCLSSASA-N

Properties

• Density: 1.42g/cm³ (Cal.)