L-Threonyl-L-lysyl-L-prolyl-L-lysyl-L-threonyl-L-lysyl-L-prolyl-N⁵-(diaminomethylene)-L-ornithine
[CAS# 88171-14-6]

Identification

• Name: L-Threonyl-L-lysyl-L-prolyl-L-lysyl-L-threonyl-L-lysyl-L-prolyl-N⁵-(diaminomethylene)-L-ornithine
• Synonyms: 4-Lys-tuftsinyltuftsin; L-Arginine, N2-(1-(N2-(N-(N2-(1-(N2-L-threonyl-L-lysyl)-L-prolyl)-L-lysyl)-L-threonyl)-L-lysyl)-L-prolyl)-; Tuftsinyltuftsin, lys(4)-
• Molecular Formula: C₄₂H₇₈N₁₄O₁₁
• Molecular Weight: 955.16
• CAS Registry Number: 88171-14-6
• SMILES: O=C(N[C@H](C(=O)O)CCC/N=C(\N)N)[C@H]2N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1N(C(=O)[C@@H](NC(=O)[C@@H](N)[C@H](O)C)CCCCN)CCC1)CCCCN)[C@H](O)C)CCCCN)CCC2
• InChI: 1S/C42H78N14O11/c1-24(57)32(46)37(62)51-27(13-4-7-19-44)39(64)55-22-10-16-30(55)35(60)50-26(12-3-6-18-43)34(59)54-33(25(2)58)38(63)52-28(14-5-8-20-45)40(65)56-23-11-17-31(56)36(61)53-29(41(66)67)15-9-21-49-42(47)48/h24-33,57-58H,3-23,43-46H2,1-2H3,(H,50,60)(H,51,62)(H,52,63)(H,53,61)(H,54,59)(H,66,67)(H4,47,48,49)/t24-,25-,26+,27+,28+,29+,30+,31+,32+,33+/m1/s1
• InChIKey: FVVLRUZIJVFAPE-DKQVQIRYSA-N

Properties

• Density: 1.475g/cm³ (Cal.)