CAS No.59401-28-4,TRP-HIS-TRP-LEU-GLN-LEU-LYS-PRO-GLY-GLN-PRO-MET-TYR Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	59401-28-4
Name:	TRP-HIS-TRP-LEU-GLN-LEU-LYS-PRO-GLY-GLN-PRO-MET-TYR

Formula:	C₈₂H₁₁₄N₂₀O₁₇S
Molecular Weight:	1684
Synonyms:	114: PN:US6100042 SEQID: 43 unclaimed sequence;126: PN: US20090238811 SEQID: 178unclaimed protein;178: PN: WO2009155115 SEQID: 178 claimed protein;79: PN:US6255059 SEQID: 26 unclaimed sequence;Factor a1 (Saccharomyces cerevisiae);asc1-Pheromone;
Density:	1.338 g/cm³
Boiling Point:	1995.8 °C at 760 mmHg
Flash Point:	1160.8 °C
Solubility:	H₂O: 1 mg/mL, clear, colorless
Appearance:	WHITE POWDER
Safety:	22-24/25
PSA:	612.93000
LogP:	6.31310

Total:34 Page 1 of 1 1

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Specification

The L-Tyrosine,L-tryptophyl-L-histidyl-L-tryptophyl-L-leucyl-L-glutaminyl-L-leucyl-L-lysyl-L-prolylglycyl-L-glutaminyl-L-prolyl-L-methionyl- is an organic compound with the formula C₈₂H₁₁₄N₂₀O₁₇S. The systematic name of this chemical is L-tryptophyl-L-histidyl-L-tryptophyl-L-leucyl-L-glutaminyl-L-leucyl-L-lysyl-L-prolylglycyl-L-glutaminyl-L-prolyl-L-methionyl-L-tyrosine. With the CAS registry number 59401-28-4, it is also named as alpha1-Mating Factor acetate salt. The product's categories are Yeast Pheromones; Yeast PheromonesPeptides for Cell Biology;Hormones; Miscellaneous Peptides; Other Protein/Peptide Hormones; Peptide. When you are using it, avoid contact with skin and eyes and do not breathe dust.

Physical properties about L-Tyrosine,L-tryptophyl-L-histidyl-L-tryptophyl-L-leucyl-L-glutaminyl-L-leucyl-L-lysyl-L-prolylglycyl-L-glutaminyl-L-prolyl-L-methionyl- are: (1)ACD/LogP: 2.85; (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: 37; (8)#H bond donors: 23; (9)#Freely Rotating Bonds: 51; (10)Polar Surface Area: 379.33 Å²; (11)Index of Refraction: 1.625; (12)Molar Refractivity: 445.1 cm³; (13)Molar Volume: 1257.6 cm³; (14)Polarizability: 176.45×10^-24cm³; (15)Surface Tension: 69.2 dyne/cm; (16)Density: 1.338 g/cm³; (17)Flash Point: 1160.8 °C; (18)Enthalpy of Vaporization: 347.72 kJ/mol; (19)Boiling Point: 1995.8 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(O)cc1)CCSC)[C@H]8N(C(=O)[C@@H](NC(=O)CNC(=O)[C@H]7N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc3c2ccccc2nc3)Cc4n cnc4)Cc6c5ccccc5nc6)CC(C)C)CCC(=O)N)CC(C)C)CCCCN)CCC7)CCC(=O)N)CCC8
(2)InChI: InChI=1/C82H114N20O17S/c1-45(2)34-61(98-76(112)63(38-49-41-89-56-17-9-7-15-53(49)56)99-77(113)64(39-50-42-87-44-91-50)96-71(107)54(84)37-48-40-88-55-16-8-6-14-52(48)55)74(110)93-57(25-27-68(85)104)72(108)97-62(35-46(3)4)75(111)95-59(18-10-11-30-83)80(116)101-31-12-19-66(101)78(114)90-43-70(106)92-60(26-28-69(86)105)81(117)102-32-13-20-67(102)79(115)94-58(29-33-120-5)73(109)100-65(82(118)119)36-47-21-23-51(103)24-22-47/h6-9,14-17,21-24,40-42,44-46,54,57-67,88-89,103H,10-13,18-20,25-39,43,83-84H2,1-5H3,(H2,85,104)(H2,86,105)(H,87,91)(H,90,114)(H,92,106)(H,93,110)(H,94,115)(H,95,111)(H,96,107)(H,97,108)(H,98,112)(H,99,113)(H,100,109)(H,118,119)/t54-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-/m0/s1
(3)InChIKey: SBKVPJHMSUXZTA-MEJXFZFPBI
(4)Std. InChI: InChI=1S/C82H114N20O17S/c1-45(2)34-61(98-76(112)63(38-49-41-89-56-17-9-7-15-53(49)56)99-77(113)64(39-50-42-87-44-91-50)96-71(107)54(84)37-48-40-88-55-16-8-6-14-52(48)55)74(110)93-57(25-27-68(85)104)72(108)97-62(35-46(3)4)75(111)95-59(18-10-11-30-83)80(116)101-31-12-19-66(101)78(114)90-43-70(106)92-60(26-28-69(86)105)81(117)102-32-13-20-67(102)79(115)94-58(29-33-120-5)73(109)100-65(82(118)119)36-47-21-23-51(103)24-22-47/h6-9,14-17,21-24,40-42,44-46,54,57-67,88-89,103H,10-13,18-20,25-39,43,83-84H2,1-5H3,(H2,85,104)(H2,86,105)(H,87,91)(H,90,114)(H,92,106)(H,93,110)(H,94,115)(H,95,111)(H,96,107)(H,97,108)(H,98,112)(H,99,113)(H,100,109)(H,118,119)/t54-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-/m0/s1
(5)Std. InChIKey: SBKVPJHMSUXZTA-MEJXFZFPSA-N