6-(N-epsilon-(4-Azidobenzoyl)Lysine)-Lhrh
[CAS# 78527-81-8]

Identification

• Name: 6-(N-epsilon-(4-Azidobenzoyl)Lysine)-Lhrh
• Synonyms: Gnrh, N-Epsilon-Azidobenzoyl-Lys(6)-; Lhrh, N-Epsilon-(4-Azidobenzoyl)Lysine(6)-; Lhrh, N-Epsilon-Azidobenzoyl-Lys(6)-
• Molecular Formula: C₆₆H₈₇N₂₁O₁₄
• Molecular Weight: 1398.55
• CAS Registry Number: 78527-81-8
• SMILES: [C@@H]1(N(CCC1)C([C@@H](NC([C@H](CC(C)C)NC([C@H](NC([C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC([C@H](CC2=CN=C[NH]2)NC([C@@H]3CCC(N3)=O)=O)=O)CC4=C[NH]C5=C4C=CC=C5)CC6=CC=C(C=C6)O)=O)CCCCNC(C7=CC=C(C=C7)N=[N+]=[N-])=O)=O)=O)CCCNC(N)=N)=O)C(NCC(=O)N)=O
• InChI: 1S/C66H87N21O14/c1-36(2)27-48(59(95)79-47(12-7-25-73-66(68)69)65(101)87-26-8-13-53(87)64(100)75-33-54(67)90)80-57(93)45(11-5-6-24-72-56(92)38-16-18-40(19-17-38)85-86-70)78-60(96)49(28-37-14-20-42(89)21-15-37)81-63(99)52(34-88)84-61(97)50(29-39-31-74-44-10-4-3-9-43(39)44)82-62(98)51(30-41-32-71-35-76-41)83-58(94)46-22-23-55(91)77-46/h3-4,9-10,14-21,31-32,35-36,45-53,74,88-89H,5-8,11-13,22-30,33-34H2,1-2H3,(H2,67,90)(H,71,76)(H,72,92)(H,75,100)(H,77,91)(H,78,96)(H,79,95)(H,80,93)(H,81,99)(H,82,98)(H,83,94)(H,84,97)(H4,68,69,73)/t45-,46+,47+,48+,49+,50+,51+,52+,53+/m1/s1
• InChIKey: ICBDNACRYZLHNF-OIAWHVPDSA-N