(3S,6S,9S,12S)-12-Isopropyl-3-methyl-9-{3-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-propyl}-6-phenylselanylmethyl-1-oxa-4,7,10-triaza-cyclododecane-2,5,8,11-tetraone

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Chemical Name:(3S,6S,9S,12S)-12-Isopropyl-3-methyl-9-{3-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-propyl}-6-phenylselanylmethyl-1-oxa-4,7,10-triaza-cyclododecane-2,5,8,11-tetraone
CAS No.:338735-92-5
Molecular Formula:C₃₀H₃₃F₃N₆O₇Se
Molecular Weight:725.583
Hs Code.:

(3S,6S,9S,12S)-12-Isopropyl-3-methyl-9-{3-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-propyl}-6-phenylselanylmethyl-1-oxa-4,7,10-triaza-cyclododecane-2,5,8,11-tetraone

Synonyms:(3S,6S,9S,12S)-12-Isopropyl-3-methyl-9-{3-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-propyl}-6-phenylselanylmethyl-1-oxa-4,7,10-triaza-cyclododecane-2,5,8,11-tetraone

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Chemical Property of (3S,6S,9S,12S)-12-Isopropyl-3-methyl-9-{3-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-propyl}-6-phenylselanylmethyl-1-oxa-4,7,10-triaza-cyclododecane-2,5,8,11-tetraone

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Technology Process of (3S,6S,9S,12S)-12-Isopropyl-3-methyl-9-{3-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-propyl}-6-phenylselanylmethyl-1-oxa-4,7,10-triaza-cyclododecane-2,5,8,11-tetraone

There total 13 articles about (3S,6S,9S,12S)-12-Isopropyl-3-methyl-9-{3-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-propyl}-6-phenylselanylmethyl-1-oxa-4,7,10-triaza-cyclododecane-2,5,8,11-tetraone 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: 99.0%

: (S)-2-{(S)-2-[(S)-2-((S)-2-Amino-3-phenylselanyl-propionylamino)-propionyloxy]-3-methyl-butyrylamino}-5-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-pentanoic acid; hydrochloride

: 338735-92-5
(3S,6S,9S,12S)-12-Isopropyl-3-methyl-9-{3-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-propyl}-6-phenylselanylmethyl-1-oxa-4,7,10-triaza-cyclododecane-2,5,8,11-tetraone

Guidance literature:: With pentafluorophenyl diphenyl-phosphinate; N-ethyl-N,N-diisopropylamine; at 20 ℃; for 12h;
DOI:10.3987/com-00-s(i)90

Reference yield:

: 60008-23-3
Boc-L-Ala-L-Hmb-OBzl

: 338735-92-5
(3S,6S,9S,12S)-12-Isopropyl-3-methyl-9-{3-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-propyl}-6-phenylselanylmethyl-1-oxa-4,7,10-triaza-cyclododecane-2,5,8,11-tetraone

Guidance literature:: Multi-step reaction with 6 steps

1: 100 percent / H₂ / Pd-C / methanol; H₂O / 12 h / 20 °C

2: 89 percent / HOBt; NMM; DCC / tetrahydrofuran / 12 h / 20 °C

3: 62 percent / HCl / ethyl acetate / 1 h / 20 °C

4: 93 percent / HOBt; EDC / dimethylformamide / 12 h / 20 °C

5: 97 percent / TFA; HCl / 2 h / 20 °C

6: 99 percent / i-Pr₂NEt; FDPP / 12 h / 20 °C

With 4-methyl-morpholine; hydrogenchloride; pentafluorophenyl diphenyl-phosphinate; hydrogen; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; N-ethyl-N,N-diisopropylamine; dicyclohexyl-carbodiimide; trifluoroacetic acid; palladium on activated charcoal; In tetrahydrofuran; methanol; water; ethyl acetate; N,N-dimethyl-formamide;
DOI:10.3987/com-00-s(i)90

Reference yield:

: 60008-24-4
Boc-L-Ala-L-Hmb-OH

: 338735-92-5
(3S,6S,9S,12S)-12-Isopropyl-3-methyl-9-{3-[2-nitro-4-(3-trifluoromethyl-3H-diazirin-3-yl)-phenyl]-propyl}-6-phenylselanylmethyl-1-oxa-4,7,10-triaza-cyclododecane-2,5,8,11-tetraone

Guidance literature:: Multi-step reaction with 5 steps

1: 89 percent / HOBt; NMM; DCC / tetrahydrofuran / 12 h / 20 °C

2: 62 percent / HCl / ethyl acetate / 1 h / 20 °C

3: 93 percent / HOBt; EDC / dimethylformamide / 12 h / 20 °C

4: 97 percent / TFA; HCl / 2 h / 20 °C

5: 99 percent / i-Pr₂NEt; FDPP / 12 h / 20 °C

With 4-methyl-morpholine; hydrogenchloride; pentafluorophenyl diphenyl-phosphinate; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; N-ethyl-N,N-diisopropylamine; dicyclohexyl-carbodiimide; trifluoroacetic acid; In tetrahydrofuran; ethyl acetate; N,N-dimethyl-formamide;
DOI:10.3987/com-00-s(i)90