PMSA-617

Base Information

• Chemical Name: PMSA-617
• CAS No.: 1702967-37-0
• Molecular Formula: C₄₉H₇₁N₉O₁₆
• Molecular Weight: 1042.15
• Mol file: 1702967-37-0.mol

Synonyms:

Chemical Property of PMSA-617

Chemical Property:

• Boiling Point: 1371.9±65.0 °C(Predicted)
• Density: 1.322±0.06 g/cm3(Predicted)

Purity/Quality:

97% ^*data from raw suppliers

PSMA-617 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Uses: PSMA-617 has been used in prostate cancer research, and is a promising prostate-specific membrane antigen-targeted theranostic agent.

Technology Process of PMSA-617

There total 10 articles about PMSA-617 which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 64.0%

tri-tert-butyl (3S,10S,14S)-3-[(naphthalen-2-yl)methyl]-1,4,12-trioxo-1-[(1r,4S)-4-({2-[4,7,10-tris(2-tert-butoxy-2-oxoethyl)-1,4,7,10-tetraazacyclododecan-1-yl]acetamido}methyl)cyclohexyl]-2,5,11,13-tetraazahexadecane-10,14,16-tricarboxylate → (3S,10S,14S)-3-[(naphthalen-2-yl)methyl]-1,4,12-trioxo-1-[(1r,4S)-4-({2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetraazacyclododecan-1-yl]acetamido}methyl)cyclohexyl]-2,5,11,13-tetraazahexadecane-10,14,16-tricarboxylic acid (1702967-37-0)

Guidance literature:

With trifluoroacetic acid; In dichloromethane; at 18 - 25 ℃; Inert atmosphere;

Reference yield: 25.0%

Fmoc-Lys(ivDde)-Wang resin + C14H23NO5 + (1R,4R)-4-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]cyclohexane-1-carboxylic acid (167690-53-1) + 1,4,7-tris(tert-butoxycarbonylmethyl)-1,4,7,10-tetraazacyclododecane-10-acetic acid (137076-54-1) → PMSA-617 (1702967-37-0)

Guidance literature:

Fmoc-Lys(ivDde)-Wang resin; C₁₄H₂₃NO₅; With hydrazine; In N,N-dimethyl-formamide; Wang resin

(1r,4r)-4-(((((9H-fluoren-9-yl)methoxy)carbonyl)amino)methyl)cyclohexane-1-carboxylic acid; 1,4,7-tris(tert-butoxycarbonylmethyl)-1,4,7,10-tetraazacyclododecane-10-acetic acid; In N,N-dimethyl-formamide; Wang resin

With trifluoroacetic acid; In N,N-dimethyl-formamide;

Reference yield:

C40H52N3O7Pol + (1R,4R)-4-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]cyclohexane-1-carboxylic acid (167690-53-1) + N-(9-fluorenylmethoxycarbonyl)-3-(β-naphthyl)-L-alanine (138774-94-4,186320-03-6) + 1,4,7-tris(tert-butoxycarbonylmethyl)-1,4,7,10-tetraazacyclododecane-10-acetic acid (137076-54-1) → (3S,10S,14S)-3-[(naphthalen-2-yl)methyl]-1,4,12-trioxo-1-[(1r,4S)-4-({2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetraazacyclododecan-1-yl]acetamido}methyl)cyclohexyl]-2,5,11,13-tetraazahexadecane-10,14,16-tricarboxylic acid (1702967-37-0)

Guidance literature:

C₄₀H₅₂N₃O₇Pol; With trifluoroacetic acid; In dichloromethane; Wang resin Inert atmosphere;

N-(9-fluorenylmethoxycarbonyl)-3-(β-naphthyl)-L-alanine; With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; for 1h; Wang resin Inert atmosphere;

(1r,4r)-4-(((((9H-fluoren-9-yl)methoxy)carbonyl)amino)methyl)cyclohexane-1-carboxylic acid; 1,4,7-tris(tert-butoxycarbonylmethyl)-1,4,7,10-tetraazacyclododecane-10-acetic acid; Solvent; Reagent/catalyst;

upstream raw materials:

1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetic acid mono(N-hydroxysuccinimidyl ester)

(1R,4R)-4-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]cyclohexane-1-carboxylic acid

N-(9-fluorenylmethoxycarbonyl)-3-(β-naphthyl)-L-alanine

1,4,7-tris(tert-butoxycarbonylmethyl)-1,4,7,10-tetraazacyclododecane-10-acetic acid