Deslorelin

1. Introduction of Deslorelin

Deslorelin, with the IUPAC Name of N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[1-[[(2S)-5-(Diaminomethylideneamino)-1-[(2S)-2-(ethylcarbamoyl)pyrrolidin-1-yl]-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide, is one kind of white powder. The Product Categories of this chemical is Peptide.

2. Properties Deslorelin

Deslorelin has the following property datas: (1)Density: 1.48 g/cm³; (2)Index of Refraction: 1.709; (3)Molar Refractivity: 337.34 cm³; (4)Molar Volume: 863.7 cm³; (5)Surface Tension: 65.5 dyne/cm; (6)Appearance: wite powder or almost white powder; (7)Sorage Tmp: -20 °C; (8)XLogP3-AA: 1.1; (9)H-Bond Donor: 16; (10)H-Bond Acceptor: 16; (11)Rotatable Bond Count: 32; (12)Tautomer Count: 998; (13)Exact Mass: 1281.640711; (14)MonoIsotopic Mass: 1281.640711; (15)Topological Polar Surface Area: 447; (16)Heavy Atom Count: 93.

3. Structure Descriptors of Deslorelin

You could convert the following datas into the molecular structure:
(1). InChI: InChI=1S/C64H83N17O12/c1-4-68-62(92)53-16-10-24-81(53)63(93)46(15-9-23-69-64(65)66)74-56(86)47(25-35(2)3)75-58(88)49(27-37-30-70-43-13-7-5-11-41(37)43)77-57(87)48(26-36-17-19-40(83)20-18-36)76-61(91)52(33-82)80-59(89)50(28-38-31-71-44-14-8-6-12-42(38)44)78-60(90)51(29-39-32-67-34-72-39)79-55(85)45-21-22-54(84)73-45/h5-8,11-14,17-20,30-32,34-35,45-53,70-71,82-83H,4,9-10,15-16,21-29,33H2,1-3H3,(H,67,72)(H,68,92)(H,73,84)(H,74,86)(H,75,88)(H,76,91)(H,77,87)(H,78,90)(H,79,85)(H,80,89)(H4,65,66,69)/t45?,46-,47?,48-,49+,50-,51-,52-,53-/m0/s1 
(2). InChIKey: InChIKey=GJKXGJCSJWBJEZ-YBPHYSDRSA-N 
(3). Smiles: c1(C[C@@H](C(N[C@@H](CO)C(N[C@H](C(N[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(N2CCC[C@H]2C(=O)NCC)=O)CCCNC(N)=N)Cc2c[nH]c3ccccc23)=O)Cc2ccc(cc2)O)=O)=O)NC([C@H](Cc2cnc[nH]2)NC([C@@H]2NC(=O)CC2)=O)=O)c2c([nH]c1)cccc2

4. Safety Information of Deslorelin

Hazard Codes: T
Risk Statements: 60 
R60:May impair fertility.
Safety Statements: 53-22-36/37/39-45 
S53:Avoid exposure - obtain special instructions before use. 
S22:Do not breathe dust. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection. 
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
WGK Germany: 3
RTECS: OK6755000
Human and experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic vapors of NO_x.

5. Use of Deslorelin

Deslorelin is primarily used for the initial flare effect upon the pituitary, and its associated surge of LH secretion. It is currently approved for use in veterinary medicine and is used to induce ovulation in mares as part of the artificial insemination process. It is also used to stabilize high-risk pregnancies, mainly of livestock.

6.  Production of Deslorelin

Using the corresponding protected amino acid monomers as the raw material. And Deslorelin is obtained by solid-phase synthesis or liquid phase synthesis.