Iodoacetamide → CID 76588547

반응식

[I:44][CH2:45][C:46](=[O:47])[NH2:48].[NH2:1][CH:2]1[CH2:3][CH2:4][N:5]([C:8](=[O:9])[N:10]2[C:11]([c:31]3[cH:32][n:33][c:34]([C:40]([CH3:41])([CH3:42])[CH3:43])[cH:35][c:36]3[O:37][CH2:38][CH3:39])=[N:12][C:13]([CH3:23])([c:24]3[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]3)[C:14]2([CH3:15])[c:16]2[cH:17][cH:18][c:19]([Cl:22])[cH:20][cH:21]2)[CH2:6][CH2:7]1>>[NH:1]([CH:2]1[CH2:3][CH2:4][N:5]([C:8](=[O:9])[N:10]2[C:11]([c:31]3[cH:32][n:33][c:34]([C:40]([CH3:41])([CH3:42])[CH3:43])[cH:35][c:36]3[O:37][CH2:38][CH3:39])=[N:12][C:13]([CH3:23])([c:24]3[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]3)[C:14]2([CH3:15])[c:16]2[cH:17][cH:18][c:19]([Cl:22])[cH:20][cH:21]2)[CH2:6][CH2:7]1)[CH2:45][C:46](=[O:47])[NH2:48]

참가 물질

반응물 2

HCID 3727Iodoacetamide

HCID 178466405CID 76588472

생성물 1

HCID 178466408CID 76588547

출처 및 근거

ORD 기록: ord-bb556fe0b59d45f0938d81f06db3e486
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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