(3S,4aS,8aS)-2-{(S)-3-[((2S,5R,6R)-3,3-Dimethyl-7-oxo-6-phenylacetylamino-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl)-amino]-2-hydroxy-propyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

Base Information

Chemical Name:(3S,4aS,8aS)-2-{(S)-3-[((2S,5R,6R)-3,3-Dimethyl-7-oxo-6-phenylacetylamino-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl)-amino]-2-hydroxy-propyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide
CAS No.:149057-18-1
Molecular Formula:C₃₃H₄₉N₅O₅S
Molecular Weight:627.849
Hs Code.:

(3S,4aS,8aS)-2-{(S)-3-[((2S,5R,6R)-3,3-Dimethyl-7-oxo-6-phenylacetylamino-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl)-amino]-2-hydroxy-propyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

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Chemical Property of (3S,4aS,8aS)-2-{(S)-3-[((2S,5R,6R)-3,3-Dimethyl-7-oxo-6-phenylacetylamino-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl)-amino]-2-hydroxy-propyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

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Technology Process of (3S,4aS,8aS)-2-{(S)-3-[((2S,5R,6R)-3,3-Dimethyl-7-oxo-6-phenylacetylamino-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl)-amino]-2-hydroxy-propyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

There total 3 articles about (3S,4aS,8aS)-2-{(S)-3-[((2S,5R,6R)-3,3-Dimethyl-7-oxo-6-phenylacetylamino-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl)-amino]-2-hydroxy-propyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide 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:

: 128019-40-9,149510-73-6,136465-81-1,168899-60-3
(3S,4aS,8aS)-N-tert-butyl-decahydroisoquinoline-3-carboxamide

: 149057-18-1
(3S,4aS,8aS)-2-{(S)-3-[((2S,5R,6R)-3,3-Dimethyl-7-oxo-6-phenylacetylamino-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl)-amino]-2-hydroxy-propyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

Guidance literature:: Multi-step reaction with 3 steps

1: 31 percent / ethanol / 20 h / Ambient temperature

2: HCl (gas) / dioxane / Ambient temperature

3: DIPEA, TBTU / dimethylformamide / 2 h / Ambient temperature

With hydrogenchloride; O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; N-ethyl-N,N-diisopropylamine; In 1,4-dioxane; ethanol; N,N-dimethyl-formamide;
DOI:10.1021/jm00048a007

Reference yield:

: 148982-78-9
(2'S,3''S,4a''R,8a''S)-n-<2-hydroxy-3-<3-<<(1,1-dimethylethyl)amino>carbonyl>decahydro-2-isoquinolinyl>propyl>carbamic acid 1,1-dimethylethyl ester

: 149057-18-1
(3S,4aS,8aS)-2-{(S)-3-[((2S,5R,6R)-3,3-Dimethyl-7-oxo-6-phenylacetylamino-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl)-amino]-2-hydroxy-propyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

Guidance literature:: Multi-step reaction with 2 steps

1: HCl (gas) / dioxane / Ambient temperature

2: DIPEA, TBTU / dimethylformamide / 2 h / Ambient temperature

With hydrogenchloride; O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; N-ethyl-N,N-diisopropylamine; In 1,4-dioxane; N,N-dimethyl-formamide;
DOI:10.1021/jm00048a007

Reference yield:

: 39879-63-5
penicillin-G N-ethylpiperidine salt

: (3S,4aS,8aS)-2-((S)-3-Amino-2-hydroxy-propyl)-decahydro-isoquinoline-3-carboxylic acid tert-butylamide; hydrochloride

: 149057-18-1
(3S,4aS,8aS)-2-{(S)-3-[((2S,5R,6R)-3,3-Dimethyl-7-oxo-6-phenylacetylamino-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl)-amino]-2-hydroxy-propyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

Guidance literature:: With O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; for 2h; Ambient temperature;
DOI:10.1021/jm00048a007