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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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HCID 58168154, 화합물 → HCID 58168331, 화합물

HRID 1029287
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HRID 1029287 반응식
[N+:1]([C:4]1[CH:26]=[CH:25][CH:24]=[CH:23][C:5]=1[CH2:6][NH:7][C:8]1[CH:22]=[CH:21][C:11]2[C:12](=[O:20])[NH:13][C:14]3[C:19]([C:10]=2[CH:9]=1)=[CH:18][CH:17]=[CH:16][N:15]=3)([O-])=O>CO.[Pd]>[NH2:1][C:4]1[CH:26]=[CH:25][CH:24]=[CH:23][C:5]=1[CH2:6][NH:7][C:8]1[CH:22]=[CH:21][C:11]2[C:12](=[O:20])[NH:13][C:14]3[C:19]([C:10]=2[CH:9]=1)=[CH:18][CH:17]=[CH:16][N:15]=3
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

4

반응물 1

HCID 58168154HCID 58168154, 화합물

생성물 1

HCID 58168331HCID 58168331, 화합물수율 24%

시약·촉매·용매 2

HCID 23938Palladium촉매HCID 887Methanol용매

실험 절차

466 (21 mg, 0.6 mmol) was dissolved in MeOH (130 mL) then reduced by flow chemistry on an H-Cube instrument (Pd/C cartridge, flow rate of 1.9 mL/min, 10 bar). The reaction solution was concentrated and purified via prep-LC-MS to provide 467 (5 mg, 24% yield) as a white powder. LC-MS (M+H=317, obsd.=317). 1H NMR (400 MHz, DMSO-D6) δ 8.53 (d, J=9.0, 2H), 8.22 (s, 1H), 8.07 (d, J=8.6, 1H), 7.42 (s, 1H), 7.34 (d, J=5.0, 1H), 6.84 (m, 2H), 6.66 (dd, J=7.5, 20.2, 2H), 6.34 (s, 1H), 6.20 (s, 2H), 5.46 (s, 2H), 5.32 (s, 1H).

후처리

  1. concentrationThe reaction solution was concentrated
  2. custompurified via prep-LC-MS

출처 및 근거

ORD 기록
ord-125c170d2cf242909b0ca2fab2121334
출처 데이터셋
uspto-grants-2014_05
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08735584B2

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