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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Hydroxide → 4-[4-[(7-Oxo-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),10,12-trien-11-yl)methyl]piperazin-1-yl]benzoic acid

HRID 2340722
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인쇄 미리보기

반응식

HRID 2340722 반응식
[CH2:35]1[O:36][CH2:37][CH2:38][O:39][CH2:40]1.[Li+:34].[O:1]=[C:2]1[CH:3]2[N:4]([c:5]3[c:6]([cH:8][c:9]([CH2:12][N:13]4[CH2:14][CH2:15][N:16]([c:19]5[cH:20][cH:21][c:22]([C:23](=[O:24])[O:25][CH2:26][CH3:27])[cH:28][cH:29]5)[CH2:17][CH2:18]4)[cH:10][n:11]3)[NH:7]1)[CH2:30][CH2:31][CH2:32]2.[OH-:33]>>[O:1]=[C:2]1[CH:3]2[N:4]([c:5]3[c:6]([cH:8][c:9]([CH2:12][N:13]4[CH2:14][CH2:15][N:16]([c:19]5[cH:20][cH:21][c:22]([C:23](=[O:24])[OH:25])[cH:28][cH:29]5)[CH2:17][CH2:18]4)[cH:10][n:11]3)[NH:7]1)[CH2:30][CH2:31][CH2:32]2
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참가 물질

5

반응물 4

HCID 961HydroxideHCID 28486Lithium ionHCID 312751,4-DioxaneHCID 75236113Ethyl 4-[4-[(7-oxo-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),10,12-trien-11-yl)methyl]piperazin-1-yl]benzoate

생성물 1

HCID 667752304-[4-[(7-Oxo-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),10,12-trien-11-yl)methyl]piperazin-1-yl]benzoic acid

출처 및 근거

ORD 기록
ord-0450c7c0377b4587abf8bdc9d58519e2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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