InChI: | InChI=1/C11H20N2O5/c1-6(2)5-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h6-8H,3-5,12H2,1-2H3,(H,13,14)(H,15,16)(H,17,18) |
Specification: |
The N-L-gamma-Glutamyl-L-leucine, with cas registry number 2566-39-4, belongs to the following product categories: (1)Dipeptides; (2)Dipeptides and Tripeptides; (3)Peptides. It has the systematic name of L-γ-glutamyl-L-leucine. And its IUPAC name is (2S)-2-[[(4S)-4-amino-5-hydroxy-5-oxopentanoyl]amino]-4-methylpentanoic acid. This chemical should be stored at the temperature of 2-8°C.
Physical properties about this chemical are: (1)ACD/LogP: -0.16; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -3.63; (4)ACD/LogD (pH 7.4): -3.67; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 7; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 76.15 Å2; (13)Index of Refraction: 1.513; (14)Molar Refractivity: 63.17 cm3; (15)Molar Volume: 210.1 cm3; (16)Polarizability: 25.04×10-24cm3; (17)Surface Tension: 53.2 dyne/cm; (18)Enthalpy of Vaporization: 90.83 kJ/mol; (19)Vapour Pressure: 1.42E-13 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N[C@H](C(=O)O)CC(C)C)CC[C@H](N)C(=O)O
(2)InChI: InChI=1/C11H20N2O5/c1-6(2)5-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h6-8H,3-5,12H2,1-2H3,(H,13,14)(H,15,16)(H,17,18)/t7-,8-/m0/s1
(3)InChIKey: MYFMARDICOWMQP-YUMQZZPRBM
(4)Std. InChI: InChI=1S/C11H20N2O5/c1-6(2)5-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h6-8H,3-5,12H2,1-2H3,(H,13,14)(H,15,16)(H,17,18)/t7-,8-/m0/s1
(5)Std. InChIKey: MYFMARDICOWMQP-YUMQZZPRSA-N
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