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Methane → Methyl 2-(2-hydroxy-5-(2-(4-propylpiperazin-1-yl)ethoxy)benzamido)-4-phenylbenzoate

HRID 161819
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HRID 161819 반응식
[C:58].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:11](=[O:12])[NH:13][c:14]2[c:15]([C:16](=[O:17])[O:18][CH3:19])[cH:20][cH:21][c:22](-[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:23]2)[cH:30][c:31]([O:34][CH2:35][CH2:36][N:37]2[CH2:38][CH2:39][N:40]([CH2:43][CH2:44][CH3:45])[CH2:41][CH2:42]2)[cH:32][cH:33]1.[CH3:50][OH:51].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[CH:46]([Cl:47])([Cl:48])[Cl:49].[Pd:59]>>[OH:8][c:9]1[c:10]([C:11](=[O:12])[NH:13][c:14]2[c:15]([C:16](=[O:17])[O:18][CH3:19])[cH:20][cH:21][c:22](-[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:23]2)[cH:30][c:31]([O:34][CH2:35][CH2:36][N:37]2[CH2:38][CH2:39][N:40]([CH2:43][CH2:44][CH3:45])[CH2:41][CH2:42]2)[cH:32][cH:33]1
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반응물 6

HCID 297MethaneHCID 887MethanolHCID 6212ChloroformHCID 8857Ethyl AcetateHCID 23938PalladiumHCID 66990571Methyl 2-(2-(benzyloxy)-5-(2-(4-propylpiperazin-1-yl)ethoxy)benzamido)-4-phenylbenzoate

생성물 1

HCID 58508918
Methyl 2-(2-hydroxy-5-(2-(4-propylpiperazin-1-yl)ethoxy)benzamido)-4-phenylbenzoate

출처 및 근거

ORD 기록
ord-7f21d67670f547b1a11975672ba3930a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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