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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Trifluoroacetic acid → 1-[7-Methoxy-8-[[7-(2-methoxyphenyl)pyrrolo[2,1-f][1,2,4]triazin-2-yl]amino]-1,2,4,5-tetrahydro-3-benzazepin-3-yl]propan-2-ol

HRID 154104
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HRID 154104 반응식
[CH3:19][S:20](=[O:21])[c:22]1[n:23][n:24]2[c:25]([cH:26][n:27]1)[cH:28][cH:29][c:30]2-[c:31]1[c:32]([O:37][CH3:38])[cH:33][cH:34][cH:35][cH:36]1.[F:39][C:40]([F:41])([F:42])[C:43]([OH:44])=[O:45].[NH2:1][c:2]1[cH:3][c:4]2[c:5]([cH:15][c:16]1[O:17][CH3:18])[CH2:6][CH2:7][N:8]([CH2:11][CH:12]([CH3:13])[OH:14])[CH2:9][CH2:10]2>>[NH:1]([c:2]1[cH:3][c:4]2[c:5]([cH:15][c:16]1[O:17][CH3:18])[CH2:6][CH2:7][N:8]([CH2:11][CH:12]([CH3:13])[OH:14])[CH2:9][CH2:10]2)[c:22]1[n:23][n:24]2[c:25]([cH:26][n:27]1)[cH:28][cH:29][c:30]2-[c:31]1[c:32]([O:37][CH3:38])[cH:33][cH:34][cH:35][cH:36]1
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반응물 3

HCID 6422Trifluoroacetic acidHCID 667107912-Methanesulfinyl-7-(2-methoxy-phenyl)-pyrrolo[2,1-f][1,2,4]triazineHCID 667113931-(7-Amino-8-methoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-propan-2-ol

생성물 1

HCID 667122981-[7-Methoxy-8-[[7-(2-methoxyphenyl)pyrrolo[2,1-f][1,2,4]triazin-2-yl]amino]-1,2,4,5-tetrahydro-3-benzazepin-3-yl]propan-2-ol

출처 및 근거

ORD 기록
ord-46acac31d1a34bb9bddb737c90c04ac7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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