HCID 22336939, 화합물 → HCID 178490282, 화합물

반응식

[C:1]([O:2][C:6]([NH:7][CH:8]([CH3:9])[C:10]([NH:11][CH:12]([CH2:13][CH:14]([CH3:15])[CH3:16])[B:17]1[O:18][C:19]2([CH3:29])[CH:20]3[C:21]([CH3:27])([CH3:28])[CH:22]([CH2:23][CH:24]2[O:25]1)[CH2:26]3)=[O:30])=[O:31])([CH3:3])([CH3:4])[CH3:5].[c:32]1(-[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[cH:33][c:34]([NH:38][CH:39]([C:40]([OH:41])=[O:42])[CH2:43][c:44]2[cH:45][c:46]([O:52][CH3:53])[c:47]([O:50][CH3:51])[cH:48][cH:49]2)[cH:35][cH:36][cH:37]1>>[C:6]([NH:7][CH:8]([CH3:9])[C:10]([NH:11][CH:12]([CH2:13][CH:14]([CH3:15])[CH3:16])[B:17]1[O:18][C:19]2([CH3:29])[CH:20]3[C:21]([CH3:27])([CH3:28])[CH:22]([CH2:23][CH:24]2[O:25]1)[CH2:26]3)=[O:30])(=[O:31])[CH:39]([NH:38][c:34]1[cH:33][c:32](-[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[cH:37][cH:36][cH:35]1)[CH2:43][c:44]1[cH:45][c:46]([O:52][CH3:53])[c:47]([O:50][CH3:51])[cH:48][cH:49]1

참가 물질

반응물 2

HCID 22336939HCID 22336939, 화합물

HCID 178446593HCID 178446593, 화합물

생성물 1

HCID 178490282HCID 178490282, 화합물

출처 및 근거

ORD 기록: ord-292ef8ab7e95490997cf237d60da3bc1
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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