leucomyosuppressin

The Leucomyosuppressin(9CI), with the CAS registry number of 106884-19-9, is also known as p-Glu-asp-val-asp-his-val-phe-leu-arg-phe-NH₂. We can get it from head extracts of the cockroach Leucophaea maderae, it can inhibit evoked transmitter release at the mealworm neuromuscular junction. This chemical's molecular formula is C₅₉H₈₄N₁₆O₁₅ and molecular weight is 1257.41. What's more, its IUPAC name is (3S)-4-[[(2S)-1-[[(2S)-1-[[1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[1-[[(2R)-1-Amino-1-oxo-3-phenylpropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxo-3-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]butanoic acid.

Physical properties about the Leucomyosuppressin(9CI) are: (1)ACD/LogP: 1.07; (2)# of Rule of 5 Violations: 3; (3)#H bond acceptors: 31; (4)#H bond donors: 19; (5)#Freely Rotating Bonds: 37; (6)Polar Surface Area: 312.67 Å²; (7)Index of Refraction: 1.662; (8)Molar Refractivity: 321.39 cm³; (9)Molar Volume: 868.2 cm³; (10)Surface Tension: 61.5 dyne/cm; (11)Density: 1.44 g/cm³.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N)[C@H](NC(=O)C(NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1NC(=O)CC1)CC(=O)O)C(C)C)CC(=O)O)Cc2cncn2)C(C)C)Cc3ccccc3)CC(C)C)CCC/N=C(\N)N)Cc4ccc cc4
(2) InChI: InChI=1/C59H84N16O15/c1-30(2)22-39(52(84)67-36(18-13-21-64-59(61)62)50(82)68-38(49(60)81)23-33-14-9-7-10-15-33)69-53(85)40(24-34-16-11-8-12-17-34)72-57(89)47(31(3)4)74-55(87)41(25-35-28-63-29-65-35)70-54(86)42(26-45(77)78)73-58(90)48(32(5)6)75-56(88)43(27-46(79)80)71-51(83)37-19-20-44(76)66-37/h7-12,14-17,28-32,36-43,47-48H,13,18-27H2,1-6H3,(H2,60,81)(H,63,65)(H,66,76)(H,67,84)(H,68,82)(H,69,85)(H,70,86)(H,71,83)(H,72,89)(H,73,90)(H,74,87)(H,75,88)(H,77,78)(H,79,80)(H4,61,62,64)/t36?,37-,38+,39+,40-,41?,42-,43-,47-,48-/m0/s1
(3) InChIKey: RFZUUYLDHNDZQI-XOHVDFTBBG