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Methanol → HCID 66701213, 화합물

HRID 1554698
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HRID 1554698 반응식
[CH2:36]([CH2:37][O:38][CH3:39])[O:40][CH3:41].[CH3:1][O:2][C:3]([C:4]([CH3:5])([CH3:6])[NH:7][C:8](=[O:9])[c:10]1[c:11]([Br:20])[c:12]2[cH:13][cH:14][cH:15][cH:16][c:17]2[cH:18][cH:19]1)=[O:21].[CH3:34][OH:35].[Cl:22][c:23]1[cH:24][cH:25][c:26]([CH:29]=[CH:30][B:31]([OH:32])[OH:33])[cH:27][cH:28]1.[cH:42]1[cH:43][cH:44][c:45]([P:46]([Pd:47]([P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([P:67]([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[P:86]([c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)([c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)[c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)([c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[cH:117][cH:118]1>>[CH3:1][O:2][C:3]([C:4]([CH3:5])([CH3:6])[NH:7][C:8](=[O:9])[c:10]1[c:11]([CH:30]=[CH:29][c:26]2[cH:25][cH:24][c:23]([Cl:22])[cH:28][cH:27]2)[c:12]2[cH:13][cH:14][cH:15][cH:16][c:17]2[cH:18][cH:19]1)=[O:21]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 887MethanolHCID 80711,2-DimethoxyethaneHCID 43495432-(4-Chlorophenyl)vinylboronic acidHCID 58370136HCID 58370136, 화합물HCID 178420554HCID 178420554, 화합물

생성물 1

HCID 66701213HCID 66701213, 화합물

출처 및 근거

ORD 기록
ord-7690a14c1eff4fad8a8120414d6dc4e3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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