Name: H-LYS-LYS-PRO-TYR-ILE-LEU-OH
SKU: 139026-64-5

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Basic Information

Molecular Structure:
CAS No.:	139026-64-5
Name:	H-LYS-LYS-PRO-TYR-ILE-LEU-OH

Formula:	C₃₈H₆₄N₈O₈
Molecular Weight:	760.96
Synonyms:	11: PN: WO2009071095 SEQID: 18 unclaimed sequence;H-Lys-Lys-Pro-Tyr-Ile-Leu-OH;Neuromedin N (swine spinal cord), 2-L-lysine-(9CI);NeuromedinN (pig spinal cord), 2-L-lysine-;
Density:	1.203 g/cm³
Boiling Point:	1109.7 °C at 760 mmHg
Flash Point:	624.9 °C
PSA:	272.30000
LogP:	4.22940

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Specification

The L-Leucine,L-lysyl-L-lysyl-L-prolyl-L-tyrosyl-L-isoleucyl is an organic compound with the formula C₃₈H₆₄N₈O₈. The systematic name of this chemical is L-Lysyl-L-lysyl-L-prolyl-L-tyrosyl-L-isoleucyl-L-leucine. With the CAS registry number 139026-64-5, it is also named as (S)-2-((2S,3S)-2-((S)-2-((S)-1-((S)-6-Amino-2-((S)-2,6-diaminohexanamido)hexanoyl)pyrrolidine-2-carboxamido)-3-(4-hydroxyphenyl)propanamido)-3-methylpentanamido)-4-methylpentanoic acid. The category of the product is Peptide. Besides, it should be stored at - 15°C.

The physical properties of L-Leucine,L-lysyl-L-lysyl-L-prolyl-L-tyrosyl-L-isoleucyl are: (1)ACD/LogP: 1.77; (2)# of Rule of 5 Violations: 3; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 16; (8)#H bond donors: 12; (9)#Freely Rotating Bonds: 28; (10)Polar Surface Area: 272.3 Å²; (11)Index of Refraction: 1.559; (12)Molar Refractivity: 204.33 cm³; (13)Molar Volume: 632.4 cm³; (14)Polarizability: 81×10^-24 cm³; (15)Surface Tension: 56.2 dyne/cm; (16)Density: 1.203 g/cm³; (17)Flash Point: 624.9 °C; (18)Enthalpy of Vaporization: 170.93 kJ/mol; (19)Boiling Point: 1109.7 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)N
(2)InChI: InChI=1/C38H64N8O8/c1-5-24(4)32(36(51)44-30(38(53)54)21-23(2)3)45-34(49)29(22-25-14-16-26(47)17-15-25)43-35(50)31-13-10-20-46(31)37(52)28(12-7-9-19-40)42-33(48)27(41)11-6-8-18-39/h14-17,23-24,27-32,47H,5-13,18-22,39-41H2,1-4H3,(H,42,48)(H,43,50)(H,44,51)(H,45,49)(H,53,54)/t24-,27-,28-,29-,30-,31-,32-/m0/s1
(3)InChIKey: JDVIBJLNEIKOTF-VDXNIVNJBS
(4)Std. InChI: InChI=1S/C38H64N8O8/c1-5-24(4)32(36(51)44-30(38(53)54)21-23(2)3)45-34(49)29(22-25-14-16-26(47)17-15-25)43-35(50)31-13-10-20-46(31)37(52)28(12-7-9-19-40)42-33(48)27(41)11-6-8-18-39/h14-17,23-24,27-32,47H,5-13,18-22,39-41H2,1-4H3,(H,42,48)(H,43,50)(H,44,51)(H,45,49)(H,53,54)/t24-,27-,28-,29-,30-,31-,32-/m0/s1
(5)Std. InChIKey: JDVIBJLNEIKOTF-VDXNIVNJSA-N

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