HCID 18322900, 화합물 → HCID 178451115, 화합물

반응식

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

참가 물질

반응물 2

HCID 18322900HCID 18322900, 화합물

HCID 76114892HCID 76114892, 화합물

생성물 1

HCID 178451115HCID 178451115, 화합물

출처 및 근거

ORD 기록: ord-ab8ebd3560a647098919b0b6b2943918
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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