Leucinostatin A
[CAS# 82111-44-2]

Identification

• Name: Leucinostatin A
• Synonyms: N-[1-[[1-[[1-[[1-[[1-[[1-[[1-[[3-(1-Dimethylaminopropan-2-Ylamino)-3-Oxopropyl]Amino]-2-Methyl-1-Oxopropan-2-Yl]Amino]-2-Methyl-1-Oxopropan-2-Yl]Amino]-4-Methyl-1-Oxopentan-2-Yl]Amino]-4-Methyl-1-Oxopentan-2-Yl]Amino]-2-Methyl-1-Oxopropan-2-Yl]Amino]-3-Hydroxy-4-Methyl-1-Oxopentan-2-Yl]Amino]-6-Hydroxy-4-Methyl-1,8-Dioxodecan-2-Yl]-4-Methyl-1-(4-Methylhex-2-Enoyl)Pyrrolidine-2-Carboxamide; N-[1-[[1-[[2-[[1-[[1-[[2-[[2-[[3-[(2-Dimethylamino-1-Methyl-Ethyl)Amino]-3-Oxo-Propyl]Amino]-1,1-Dimethyl-2-Oxo-Ethyl]Amino]-1,1-Dimethyl-2-Oxo-Ethyl]Carbamoyl]-3-Methyl-Butyl]Carbamoyl]-3-Methyl-Butyl]Amino]-1,1-Dimethyl-2-Oxo-Ethyl]Carbamoyl]-2-Hydroxy-3-Methyl-Butyl]Carbamoyl]-5-Hydroxy-3-Methyl-7-Oxo-Nonyl]-4-Methyl-1-[(E)-4-Methylhex-2-Enoyl]Pyrrolidine-2-Carboxamide; N-[1-[[1-[[2-[[1-[[1-[[2-[[2-[[3-[(2-Dimethylamino-1-Methyl-Ethyl)Amino]-3-Oxo-Propyl]Amino]-1,1-Dimethyl-2-Oxo-Ethyl]Amino]-1,1-Dimethyl-2-Oxo-Ethyl]Carbamoyl]-3-Methyl-Butyl]Carbamoyl]-3-Methyl-Butyl]Amino]-1,1-Dimethyl-2-Oxo-Ethyl]Carbamoyl]-2-Hydroxy-3-Methyl-Butyl]Carbamoyl]-5-Hydroxy-3-Methyl-7-Oxo-Nonyl]-4-Methyl-1-(4-Methylhex-2-Enoyl)Pyrrolidine-2-Carboxamide
• Molecular Formula: C₆₂H₁₁₁N₁₁O₁₃
• Molecular Weight: 1218.62
• CAS Registry Number: 82111-44-2
• SMILES: C(C(NC(=O)C1N(CC(C1)C)C(=O)\C=C\C(CC)C)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCCC(=O)NC(CN(C)C)C)(C)C)(C)C)CC(C)C)CC(C)C)(C)C)C(O)C(C)C)C(CC(O)CC(=O)CC)C
• InChI: 1S/C62H111N11O13/c1-21-38(9)23-24-49(77)73-33-40(11)31-47(73)55(82)66-46(30-39(10)29-43(75)32-42(74)22-2)53(80)68-50(51(78)37(7)8)56(83)70-61(15,16)58(85)67-44(27-35(3)4)52(79)65-45(28-36(5)6)54(81)69-62(17,18)59(86)71-60(13,14)57(84)63-26-25-48(76)64-41(12)34-72(19)20/h23-24,35-41,43-47,50-51,75,78H,21-22,25-34H2,1-20H3,(H,63,84)(H,64,76)(H,65,79)(H,66,82)(H,67,85)(H,68,80)(H,69,81)(H,70,83)(H,71,86)/b24-23+
• InChIKey: FOAIGCPESMNWQP-WCWDXBQESA-N

Properties

• Density: 1.117g/cm³ (Cal.)
• Boiling point: 1408.002°C at 760 mmHg (Cal.)
• Flash point: 805.33°C (Cal.)