Cyclopropylboronic acid → HCID 25160970, 화합물

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[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7]([CH2:26][CH:27]3[CH2:28][CH2:29]3)[c:8]([CH2:10][O:11][CH2:12][C:13]3([c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[CH2:14][CH2:15][N:16]([CH3:19])[CH2:17][CH2:18]3)[n:9]2)[cH:30]1.[C:37]([c:38]1[cH:39][cH:40][c:41](-[c:42]2[cH:43][cH:44][c:45]3[n:46]([CH2:47][CH:48]4[CH2:49][CH2:50]4)[c:51]([CH2:52][O:53][CH2:54][C:55]4([c:56]5[cH:57][cH:58][cH:59][cH:60][cH:61]5)[CH2:62][CH2:63][N:64]([C:65]([O:66][C:67]([CH3:68])([CH3:69])[CH3:70])=[O:71])[CH2:72][CH2:73]4)[n:74][c:75]3[cH:76]2)[cH:77][cH:78]1)#[N:79].[CH:31]1([B:34]([OH:35])[OH:36])[CH2:32][CH2:33]1>>[c:2]1([CH:31]2[CH2:32][CH2:33]2)[cH:3][cH:4][c:5]2[c:6]([n:7]([CH2:26][CH:27]3[CH2:28][CH2:29]3)[c:8]([CH2:10][O:11][CH2:12][C:13]3([c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[CH2:14][CH2:15][N:16]([CH3:19])[CH2:17][CH2:18]3)[n:9]2)[cH:30]1

참가 물질

반응물 3

HCID 2760897Cyclopropylboronic acid

HCID 25160966HCID 25160966, 화합물

HCID 67403049HCID 67403049, 화합물

생성물 1

HCID 25160970HCID 25160970, 화합물

출처 및 근거

ORD 기록: ord-d3adb622e7d84a758ef71dc9f163c54d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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