Cholecystokinin-8(swine), 2-desulfo- (9CI) supplier

Name
H-ASP-TYR-MET-GLY-TRP-MET-ASP-PHE-NH2
EINECS
CAS No. 25679-24-7
Article Data2
CAS DataBase
Density 1.387 g/cm³
Solubility
Melting Point
Formula C₄₉H₆₂N₁₀O₁₃S₂
Boiling Point 1570.2 °C at 760 mmHg
Molecular Weight 1063.22
Flash Point 903.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Caerulein,1-de(5-oxo-L-proline)-2-de-L-glutamine-4-desulfo-5-L-methionine-;Caerulein,1-de(5-oxo-L-proline)-2-de-L-glutamine-5-L-methionine-, 4-de(hydrogen sulfate)(8CI);88: PN: US20060293232 PAGE: 15 unclaimed sequence;Cholecystokininoctapeptide (26-33 unsulfated);Cholecystokinin octapeptide desulfate;Des(SO4)-CCK-8;Desulfated CCK-8;Desulfated cholecystokinin octapeptide;Desulfo-CCK-8;Nonsulfated cholecystokinin (26-33);Nonsulfated cholecystokininoctapeptide;Nonsulfated cholecystokinin-8;Pancreozymin C-terminaloctapeptide;SQ 19265;Unsulfated cholecystokinin octapeptide;
PSA 434.03000
LogP 3.33150

Cholecystokinin-8(swine), 2-desulfo- (9CI) Specification

The CAS registry number of Cholecystokinin-8(swine), 2-desulfo- (9Cl) is 25679-24-7. It belongs to the product categories of Cholecystokinin (CCK) receptor; Peptide. This chemical's molecular formula is C₄₉H₆₂N₁₀O₁₃S₂ and molecular weight is 1063.21. What's more, its systematic name is α-Aspartyltyrosylmethionylglycyltryptophylmethionyl-α-aspartylphenylalaninamide.

Physical properties about Cholecystokinin-8(swine), 2-desulfo- (9Cl) are: (1)ACD/LogP: 2.43; (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: 23; (8)#H bond donors: 15; (9)#Freely Rotating Bonds: 33; (10)Polar Surface Area: 283.08 Å²; (11)Index of Refraction: 1.638; (12)Molar Refractivity: 275.32 cm³; (13)Molar Volume: 766 cm³; (14)Polarizability: 109.14×10^-24cm³; (15)Surface Tension: 68.2 dyne/cm; (16)Density: 1.387 g/cm³; (17)Flash Point: 903.4 °C; (18)Enthalpy of Vaporization: 256.01 kJ/mol; (19)Boiling Point: 1570.2 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(N)CC(=O)O)Cc1ccc(O)cc1)CCSC)Cc3c2ccccc2nc3)CCSC)CC(=O)O)Cc4ccccc4
(2) InChI: InChI=1/C49H62N10O13S2/c1-73-18-16-34(55-47(70)37(21-28-12-14-30(60)15-13-28)58-44(67)32(50)23-41(62)63)45(68)53-26-40(61)54-38(22-29-25-52-33-11-7-6-10-31(29)33)48(71)56-35(17-19-74-2)46(69)59-39(24-42(64)65)49(72)57-36(43(51)66)20-27-8-4-3-5-9-27/h3-15,25,32,34-39,52,60H,16-24,26,50H2,1-2H3,(H2,51,66)(H,53,68)(H,54,61)(H,55,70)(H,56,71)(H,57,72)(H,58,67)(H,59,69)(H,62,63)(H,64,65)
(3) InChIKey: OIXQINQYMGNCII-UHFFFAOYAG

Product Name

H-ASP-TYR-MET-GLY-TRP-MET-ASP-PHE-NH2

Cholecystokinin-8(swine), 2-desulfo- (9CI) Specification

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