HCID 57960940, 화합물 → HCID 57961007, 화합물

HRID 147633노트

반응식

HRID 147633 반응식
[NH2:1][c:2]1[cH:3][c:4]([O:8][c:9]2[cH:10][cH:11][c:12](-[c:13]3[n:14][c:15]([CH:16]4[CH2:17][CH2:18][CH2:19]4)[n:20]4[cH:21][cH:22][n:23][c:24]([NH2:25])[c:26]34)[cH:27][cH:28]2)[cH:5][cH:6][cH:7]1.[NH2:29][c:30]1[c:31]2[n:32]([cH:33][cH:34][n:35]1)[c:36]([CH:56]1[CH2:57][CH2:58][CH2:59]1)[n:37][c:38]2-[c:39]1[cH:40][c:41]([N+:53]([O-:54])=[O:55])[c:42]([C:45](=[O:46])[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[cH:43][cH:44]1>>[NH2:29][c:30]1[c:31]2[n:32]([cH:33][cH:34][n:35]1)[c:36]([CH:56]1[CH2:57][CH2:58][CH2:59]1)[n:37][c:38]2-[c:39]1[cH:40][c:41]([NH2:53])[c:42]([C:45](=[O:46])[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[cH:43][cH:44]1

참가 물질

3

출처 및 근거

ORD 기록
ord-4c83a0623b96424bbf2aacbabc4c8189
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

반응 노트

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