L-Lysyl-L-Glutaminyl-L-Phenylalanyl-L-Isoleucyl-L-Asparaginyl-L-Methionyl-L-Tryptophyl-L-Glutaminyl-L-alpha-Glutamyl-L-Valylglycyl-L-Lysyl-L-Alanyl-L-Methionyl-L-Tyrosyl-L-Alanyl-L-Prolyl-L-Proline
[CAS# 129318-38-3]

Identification

• Name: L-Lysyl-L-Glutaminyl-L-Phenylalanyl-L-Isoleucyl-L-Asparaginyl-L-Methionyl-L-Tryptophyl-L-Glutaminyl-L-alpha-Glutamyl-L-Valylglycyl-L-Lysyl-L-Alanyl-L-Methionyl-L-Tyrosyl-L-Alanyl-L-Prolyl-L-Proline
• Synonyms: HIV FRAGMENT; L-Lysyl-L-glutaminyl-L-phenylalanyl-L-isoleucyl-L-asparaginyl-L-methionyl-L-tryptophyl-L-glutaminyl-L-α-glutamyl-L-valylglycyl-L-lysyl-L-alanyl-L-methionyl-L-tyrosyl-L-alanyl-L-prolyl-L-prolin
• Molecular Formula: C₉₉H₁₄₈N₂₄O₂₅S₂
• Molecular Weight: 2138.51
• CAS Registry Number: 129318-38-3
• SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc3ccc(cc3)O)C(=O)N[C@@H](C)C(=O)N4CCC[C@H]4C(=O)N5CCC[C@H]5C(=O)O)NC(=O)[C@H](Cc6ccccc6)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCCN)N
• InChI: 1S/C99H148N24O25S2/c1-9-54(4)82(121-94(142)71(47-57-21-11-10-12-22-57)117-87(135)65(33-36-76(103)125)112-84(132)62(102)24-15-17-41-100)96(144)119-73(50-78(105)127)93(141)115-69(40-46-150-8)89(137)118-72(49-59-51-106-63-25-14-13-23-61(59)63)92(140)114-66(34-37-77(104)126)86(134)113-67(35-38-80(129)130)90(138)120-81(53(2)3)95(143)107-52-79(128)110-64(26-16-18-42-101)85(133)108-55(5)83(131)111-68(39-45-149-7)88(136)116-70(48-58-29-31-60(124)32-30-58)91(139)109-56(6)97(145)122-43-19-27-74(122)98(146)123-44-20-28-75(123)99(147)148/h10-14,21-23,25,29-32,51,53-56,62,64-75,81-82,106,124H,9,15-20,24,26-28,33-50,52,100-102H2,1-8H3,(H2,103,125)(H2,104,126)(H2,105,127)(H,107,143)(H,108,133)(H,109,139)(H,110,128)(H,111,131)(H,112,132)(H,113,134)(H,114,140)(H,115,141)(H,116,136)(H,117,135)(H,118,137)(H,119,144)(H,120,138)(H,121,142)(H,129,130)(H,147,148)/t54-,55-,56-,62-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,81-,82-/m0/s1
• InChIKey: FWLUYNSJWIJPKZ-WEARTWMDSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 2276.1±65.0°C at 760 mmHg (Cal.)
• Flash point: 1330.3±34.3°C (Cal.)
• Refractive index: 1.597 (Cal.)