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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Diethylamine → N-[(3R,4S,5S)-1-{(2S)-2-[(1R,2R)-3-{[2-(cyclohepta-2,4,6-trien-1-yl)ethyl]amino}-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl}-3-methoxy-5-methyl-1-oxoheptan-4-yl]-N-methyl-L-valinamide

HRID 74803
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HRID 74803 반응식
[CH:1]1([CH2:8][CH2:9][NH:10][C:11](=[O:59])[C@H:12]([CH3:58])[C@H:13]([C@@H:16]2[CH2:20][CH2:19][CH2:18][N:17]2[C:21](=[O:57])[CH2:22][C@@H:23]([O:55][CH3:56])[C@@H:24]([N:29]([CH3:54])[C:30](=[O:53])[C@H:31]([CH:50]([CH3:52])[CH3:51])[NH:32]C(OCC2C3C=CC=CC=3C3C2=CC=CC=3)=O)[C@@H:25]([CH3:28])[CH2:26][CH3:27])[O:14][CH3:15])[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=[CH:2]1.C(NCC)C>ClCCl>[CH:1]1([CH2:8][CH2:9][NH:10][C:11](=[O:59])[C@H:12]([CH3:58])[C@H:13]([C@@H:16]2[CH2:20][CH2:19][CH2:18][N:17]2[C:21](=[O:57])[CH2:22][C@@H:23]([O:55][CH3:56])[C@@H:24]([N:29]([CH3:54])[C:30](=[O:53])[C@H:31]([CH:50]([CH3:51])[CH3:52])[NH2:32])[C@@H:25]([CH3:28])[CH2:26][CH3:27])[O:14][CH3:15])[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=[CH:2]1
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참가 물질

4

반응물 2

HCID 8021DiethylamineHCID 89582252N-[(3R,4S,5S)-1-{(2S)-2-[(1R,2R)-3-{[2-(cyclohepta-2,4,6-trien-1-yl)ethyl]amino}-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl}-3-methoxy-5-methyl-1-oxoheptan-4-yl]-N~2~-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-methyl-L-valinamide

생성물 1

HCID 86685760N-[(3R,4S,5S)-1-{(2S)-2-[(1R,2R)-3-{[2-(cyclohepta-2,4,6-trien-1-yl)ethyl]amino}-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl}-3-methoxy-5-methyl-1-oxoheptan-4-yl]-N-methyl-L-valinamide수율 87%

시약·촉매·용매 1

HCID 6344Dichloromethane용매

실험 절차

According to the general procedure A, from #175 (560 mg, 0.690 mmol, 1 eq.) in dichloromethane (9 mL), and N,N-diethylamine (6.0 mL), was synthesized the crude desired compound, which was purified by by silica gel chromatography (Gradient: 0 to 50% methanol in dichloromethane) to afford #176 (351 mg, 87%) as a yellow oil. LC-MS (Protocol Q1): m/z 589.5 [M+H+], retention time=0.72 minutes.

후처리

  1. customwas synthesized the crude desired compound, which
  2. customwas purified by by silica gel chromatography (Gradient: 0 to 50% methanol in dichloromethane)

출처 및 근거

ORD 기록
ord-ed8993fb51a344bba9ce9e84608caca8
출처 데이터셋
uspto-grants-2014_09
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08828401B2

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