(2E,4E,6E,8E,10E)-11-[(S)-2-Phenyl-1-((3S,7S,13S,16S,19S)-13,16,17-trimethyl-2,6,12,15,18-pentaoxo-5-oxa-1,11,14,17-tetraaza-tricyclo[17.3.0.0^7,11]docos-3-ylcarbamoyl)-ethylcarbamoyl]-undeca-2,4,6,8,10-pentaenoic acid

Base Information

• Chemical Name: (2E,4E,6E,8E,10E)-11-[(S)-2-Phenyl-1-((3S,7S,13S,16S,19S)-13,16,17-trimethyl-2,6,12,15,18-pentaoxo-5-oxa-1,11,14,17-tetraaza-tricyclo[17.3.0.0^7,11]docos-3-ylcarbamoyl)-ethylcarbamoyl]-undeca-2,4,6,8,10-pentaenoic acid
• CAS No.: 192068-75-0
• Molecular Formula: C₄₁H₅₀N₆O₁₀
• Molecular Weight: 786.882

Synonyms:

Chemical Property of (2E,4E,6E,8E,10E)-11-[(S)-2-Phenyl-1-((3S,7S,13S,16S,19S)-13,16,17-trimethyl-2,6,12,15,18-pentaoxo-5-oxa-1,11,14,17-tetraaza-tricyclo[17.3.0.0^7,11]docos-3-ylcarbamoyl)-ethylcarbamoyl]-undeca-2,4,6,8,10-pentaenoic acid

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of (2E,4E,6E,8E,10E)-11-[(S)-2-Phenyl-1-((3S,7S,13S,16S,19S)-13,16,17-trimethyl-2,6,12,15,18-pentaoxo-5-oxa-1,11,14,17-tetraaza-tricyclo[17.3.0.0^7,11]docos-3-ylcarbamoyl)-ethylcarbamoyl]-undeca-2,4,6,8,10-pentaenoic acid

There total 12 articles about (2E,4E,6E,8E,10E)-11-[(S)-2-Phenyl-1-((3S,7S,13S,16S,19S)-13,16,17-trimethyl-2,6,12,15,18-pentaoxo-5-oxa-1,11,14,17-tetraaza-tricyclo[17.3.0.0^7,11]docos-3-ylcarbamoyl)-ethylcarbamoyl]-undeca-2,4,6,8,10-pentaenoic acid 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:

benzyl ((6S,9S,11aS,17S,20aS)-6,9,10-trimethyl-5,8,11,16,20-pentaoxohexadecahydro-1H,5H,16Hdipyrrolo[2,1-c:2',1'-l][1]oxa[4,7,10,13]tetraazacyclohexadecin-17-yl)carbamate (192068-64-7) → (2E,4E,6E,8E,10E)-11-[(S)-2-Phenyl-1-((3S,7S,13S,16S,19S)-13,16,17-trimethyl-2,6,12,15,18-pentaoxo-5-oxa-1,11,14,17-tetraaza-tricyclo[17.3.0.07,11]docos-3-ylcarbamoyl)-ethylcarbamoyl]-undeca-2,4,6,8,10-pentaenoic acid (192068-75-0)

Guidance literature:

Multi-step reaction with 5 steps

1: H₂, HCl / Pd/C / methanol / 6 h / Ambient temperature

2: HATU, Huenig base / dimethylformamide / 12 h / 0 °C

3: HBr / acetic acid / 0.5 h / Ambient temperature

4: 17 percent / HATU, Huenig base / dimethylformamide / 12 h / 0 °C

5: TFA / CH₂Cl₂ / Ambient temperature

With hydrogenchloride; hydrogen bromide; hydrogen; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; palladium on activated charcoal; In methanol; dichloromethane; acetic acid; N,N-dimethyl-formamide;

DOI:10.1002/anie.199711101

Reference yield:

C33H47N5O11 → (2E,4E,6E,8E,10E)-11-[(S)-2-Phenyl-1-((3S,7S,13S,16S,19S)-13,16,17-trimethyl-2,6,12,15,18-pentaoxo-5-oxa-1,11,14,17-tetraaza-tricyclo[17.3.0.07,11]docos-3-ylcarbamoyl)-ethylcarbamoyl]-undeca-2,4,6,8,10-pentaenoic acid (192068-75-0)

Guidance literature:

Multi-step reaction with 8 steps

1: EDC / CH₂Cl₂ / 20 h

2: HCl / dioxane / 2 h / Ambient temperature

3: aq. NaHCO₃ / CHCl₃ / 6 h / Ambient temperature

4: H₂, HCl / Pd/C / methanol / 6 h / Ambient temperature

5: HATU, Huenig base / dimethylformamide / 12 h / 0 °C

6: HBr / acetic acid / 0.5 h / Ambient temperature

7: 17 percent / HATU, Huenig base / dimethylformamide / 12 h / 0 °C

8: TFA / CH₂Cl₂ / Ambient temperature

With hydrogenchloride; hydrogen bromide; hydrogen; sodium hydrogencarbonate; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; palladium on activated charcoal; In 1,4-dioxane; methanol; dichloromethane; chloroform; acetic acid; N,N-dimethyl-formamide;

DOI:10.1002/anie.199711101

Reference yield:

C39H46F5N5O11 (192068-62-5) → (2E,4E,6E,8E,10E)-11-[(S)-2-Phenyl-1-((3S,7S,13S,16S,19S)-13,16,17-trimethyl-2,6,12,15,18-pentaoxo-5-oxa-1,11,14,17-tetraaza-tricyclo[17.3.0.07,11]docos-3-ylcarbamoyl)-ethylcarbamoyl]-undeca-2,4,6,8,10-pentaenoic acid (192068-75-0)

Guidance literature:

Multi-step reaction with 7 steps

1: HCl / dioxane / 2 h / Ambient temperature

2: aq. NaHCO₃ / CHCl₃ / 6 h / Ambient temperature

3: H₂, HCl / Pd/C / methanol / 6 h / Ambient temperature

4: HATU, Huenig base / dimethylformamide / 12 h / 0 °C

5: HBr / acetic acid / 0.5 h / Ambient temperature

6: 17 percent / HATU, Huenig base / dimethylformamide / 12 h / 0 °C

7: TFA / CH₂Cl₂ / Ambient temperature

With hydrogenchloride; hydrogen bromide; hydrogen; sodium hydrogencarbonate; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; palladium on activated charcoal; In 1,4-dioxane; methanol; dichloromethane; chloroform; acetic acid; N,N-dimethyl-formamide;

DOI:10.1002/anie.199711101

upstream raw materials:

(2E,4E,6E,8E,10E)-11-[(S)-2-Phenyl-1-((3S,7S,13S,16S,19S)-13,16,17-trimethyl-2,6,12,15,18-pentaoxo-5-oxa-1,11,14,17-tetraaza-tricyclo[17.3.0.0^7,11]docos-3-ylcarbamoyl)-ethylcarbamoyl]-undeca-2,4,6,8,10-pentaenoic acid tert-butyl ester

(2E,4E,6E)octa-2,4,6-triene-1,8-dial

(2E,4E,6E,8E,10E)-Dodeca-2,4,6,8,10-pentaenedioic acid mono-tert-butyl ester

C₂₆H₂₈O₃Si

Downstream raw materials:

C₄₆H₅₈N₆O₁₁

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