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Ethyl Acetate → 6-[5-methoxy-2-hydroxymethyl-4-(2-trimethylsilanyl-ethoxymethoxy)-phenyl]-1-(2-trimethylsilanyl-ethoxymethyl)-3-[1-(2-trimethylsilanyl-ethoxymethyl)-1H-benzoimidazol-2-yl]-1H-indazole

HRID 2319792
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HRID 2319792 반응식
[CH3:36][O:37][c:38]1[cH:39][c:40]([Sn:55]([CH3:56])([CH3:57])[CH3:58])[c:41]([CH2:53][OH:54])[cH:42][c:43]1[O:44][CH2:45][O:46][CH2:47][CH2:48][Si:49]([CH3:50])([CH3:51])[CH3:52].[CH3:65][CH2:66][O:67][C:68]([CH3:69])=[O:70].[I:1][c:2]1[cH:3][cH:4][c:5]2[c:6](-[c:19]3[n:20][c:21]4[c:22]([n:23]3[CH2:24][O:25][CH2:26][CH2:27][Si:28]([CH3:29])([CH3:30])[CH3:31])[cH:32][cH:33][cH:34][cH:35]4)[n:7][n:8]([CH2:11][O:12][CH2:13][CH2:14][Si:15]([CH3:16])([CH3:17])[CH3:18])[c:9]2[cH:10]1.[O:59]1[CH2:60][CH2:61][O:62][CH2:63][CH2:64]1>>[c:2]1(-[c:40]2[cH:39][c:38]([O:37][CH3:36])[c:43]([O:44][CH2:45][O:46][CH2:47][CH2:48][Si:49]([CH3:50])([CH3:51])[CH3:52])[cH:42][c:41]2[CH2:53][OH:54])[cH:3][cH:4][c:5]2[c:6](-[c:19]3[n:20][c:21]4[c:22]([n:23]3[CH2:24][O:25][CH2:26][CH2:27][Si:28]([CH3:29])([CH3:30])[CH3:31])[cH:32][cH:33][cH:34][cH:35]4)[n:7][n:8]([CH2:11][O:12][CH2:13][CH2:14][Si:15]([CH3:16])([CH3:17])[CH3:18])[c:9]2[cH:10]1
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 8857Ethyl AcetateHCID 312751,4-DioxaneHCID 218774466-Iodo-1-[2-(trimethyl-silanyl)-ethoxymethyl]-3-{1-[2-(trimethyl-silanyl)-ethoxymethyl]-1H-benzoimidazol-2-yl}-1H-indazoleHCID 21877510(4-Methoxy-5-(2-trimethylsilanyl-ethoxymethoxy)-2-trimethylstannanyl-phenyl]-methanol

생성물 1

HCID 21877401
6-[5-methoxy-2-hydroxymethyl-4-(2-trimethylsilanyl-ethoxymethoxy)-phenyl]-1-(2-trimethylsilanyl-ethoxymethyl)-3-[1-(2-trimethylsilanyl-ethoxymethyl)-1H-benzoimidazol-2-yl]-1H-indazole

출처 및 근거

ORD 기록
ord-1c2a8747fa3640e994fedf2f17a12170
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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