((6S,9S,12S,14aS,20S,23S,25aS)-20-benzyl-6,12-di((S)-sec-butyl)-23-isobutyl-5,8,11,14,19,22,25-heptaoxotetracosahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazacyclohenicosin-9-yl)methyl benzoate

Base Information

Chemical Name:((6S,9S,12S,14aS,20S,23S,25aS)-20-benzyl-6,12-di((S)-sec-butyl)-23-isobutyl-5,8,11,14,19,22,25-heptaoxotetracosahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazacyclohenicosin-9-yl)methyl benzoate
CAS No.:1427166-57-1
Molecular Formula:C₄₇H₆₇N₇O₈
Molecular Weight:858.091
Hs Code.:

((6S,9S,12S,14aS,20S,23S,25aS)-20-benzyl-6,12-di((S)-sec-butyl)-23-isobutyl-5,8,11,14,19,22,25-heptaoxotetracosahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazacyclohenicosin-9-yl)methyl benzoate

Synonyms:((6S,9S,12S,14aS,20S,23S,25aS)-20-benzyl-6,12-di((S)-sec-butyl)-23-isobutyl-5,8,11,14,19,22,25-heptaoxotetracosahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazacyclohenicosin-9-yl)methyl benzoate

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Chemical Property of ((6S,9S,12S,14aS,20S,23S,25aS)-20-benzyl-6,12-di((S)-sec-butyl)-23-isobutyl-5,8,11,14,19,22,25-heptaoxotetracosahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazacyclohenicosin-9-yl)methyl benzoate

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Technology Process of ((6S,9S,12S,14aS,20S,23S,25aS)-20-benzyl-6,12-di((S)-sec-butyl)-23-isobutyl-5,8,11,14,19,22,25-heptaoxotetracosahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazacyclohenicosin-9-yl)methyl benzoate

There total 17 articles about ((6S,9S,12S,14aS,20S,23S,25aS)-20-benzyl-6,12-di((S)-sec-butyl)-23-isobutyl-5,8,11,14,19,22,25-heptaoxotetracosahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazacyclohenicosin-9-yl)methyl benzoate 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: 74.0%

: 1427166-56-0
(2S,3S)-1-(((S)-3-(benzyloxy)-1-(((2S,3S)-1-((S)-2-(((S)-1-(((S)-1-((S)-2-carboxypyrrolidin-1-yl)-1-oxo-3-phenylpropan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)carbamoyl)pyrrolidin-1-yl)-3-methyl-1-oxopentan-2-yl)amino)-1-oxopropan-2-yl)amino)-3-methyl-1-oxopentan-2-aminium chloride

: 1427166-57-1
((6S,9S,12S,14aS,20S,23S,25aS)-20-benzyl-6,12-di((S)-sec-butyl)-23-isobutyl-5,8,11,14,19,22,25-heptaoxotetracosahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazacyclohenicosin-9-yl)methyl benzoate

Guidance literature:: With pentafluorophenyl diphenyl-phosphinate; N-ethyl-N,N-diisopropylamine; In acetonitrile; at 25 ℃;
DOI:10.1039/c3cc39291k

Reference yield:

: 99295-22-4
(S)-1-((S)-2-(ethoxycarbonyl)pyrrolidin-1-yl)-1-oxo-3-phenylpropan-2-aminium chloride

: 1427166-57-1
((6S,9S,12S,14aS,20S,23S,25aS)-20-benzyl-6,12-di((S)-sec-butyl)-23-isobutyl-5,8,11,14,19,22,25-heptaoxotetracosahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazacyclohenicosin-9-yl)methyl benzoate

Guidance literature:: Multi-step reaction with 6 steps

1: 4-methyl-morpholine; isobutyl chloroformate / N,N-dimethyl-formamide; tetrahydrofuran / 12 h / -15 - 25 °C / Inert atmosphere

2: hydrogenchloride / 1,4-dioxane / 1 h / 25 °C

3: 4-methyl-morpholine; isobutyl chloroformate / N,N-dimethyl-formamide; tetrahydrofuran / 12 h / -15 - 25 °C / Inert atmosphere

4: lithium hydroxide; water / tetrahydrofuran; methanol / 2 h / 25 °C

5: hydrogenchloride / 1,4-dioxane / 1 h / 25 °C

6: N-ethyl-N,N-diisopropylamine; pentafluorophenyl diphenyl-phosphinate / acetonitrile / 25 °C

With 4-methyl-morpholine; hydrogenchloride; pentafluorophenyl diphenyl-phosphinate; water; N-ethyl-N,N-diisopropylamine; lithium hydroxide; isobutyl chloroformate; In tetrahydrofuran; 1,4-dioxane; methanol; N,N-dimethyl-formamide; acetonitrile;
DOI:10.1039/c3cc39291k

Reference yield:

: 23680-31-1
BOC-O-benzyl-L-serine

: 1427166-57-1
((6S,9S,12S,14aS,20S,23S,25aS)-20-benzyl-6,12-di((S)-sec-butyl)-23-isobutyl-5,8,11,14,19,22,25-heptaoxotetracosahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazacyclohenicosin-9-yl)methyl benzoate

Guidance literature:: Multi-step reaction with 8 steps

1.1: dicyclohexyl-carbodiimide / dichloromethane / 0.5 h / Inert atmosphere

1.2: 12 h / 25 °C / Inert atmosphere

2.1: triethylamine / acetonitrile; water / 16 h

3.1: hydrogenchloride / 1,4-dioxane / 3 h / 25 °C

4.1: N-ethyl-N,N-diisopropylamine / acetonitrile / 1.5 h / 50 °C / Microwave irradiation

5.1: 4-methyl-morpholine; isobutyl chloroformate / N,N-dimethyl-formamide; tetrahydrofuran / 12 h / -15 - 25 °C / Inert atmosphere

6.1: lithium hydroxide; water / tetrahydrofuran; methanol / 2 h / 25 °C

7.1: hydrogenchloride / 1,4-dioxane / 1 h / 25 °C

8.1: N-ethyl-N,N-diisopropylamine; pentafluorophenyl diphenyl-phosphinate / acetonitrile / 25 °C

With 4-methyl-morpholine; hydrogenchloride; pentafluorophenyl diphenyl-phosphinate; water; triethylamine; N-ethyl-N,N-diisopropylamine; dicyclohexyl-carbodiimide; lithium hydroxide; isobutyl chloroformate; In tetrahydrofuran; 1,4-dioxane; methanol; dichloromethane; water; N,N-dimethyl-formamide; acetonitrile;
DOI:10.1039/c3cc39291k