4-bromo-3-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-1-pentyl-1,3-dihydro-2H-indol-2-one → ethyl [3-(6-hydroxy-1,3-benzodioxol-5-yl)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetate

반응식

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

참가 물질

반응물 2

HCID 120044004-bromo-3-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-1-pentyl-1,3-dihydro-2H-indol-2-one

HCID 58872476ethyl [3-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetate

생성물 1

HCID 58872556ethyl [3-(6-hydroxy-1,3-benzodioxol-5-yl)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetate

출처 및 근거

ORD 기록: ord-dd7b7256444f49928d313a69fac6469f
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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