Sodium ion → 2-(4-Phenylpiperazine-1-carbonyloxymethyl)-morpholine-4-carboxylic acid tert-butyl ester

HRID 172159

반응식

HRID 172159 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH2:14][OH:15])[O:11][CH2:12][CH2:13]1.[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[H-:17].[Na+:16].[c:18]1([N:24]2[CH2:25][CH2:26][N:27]([C:30](=[O:31])[O:32][c:33]3[cH:34][cH:35][c:36]([N+:37]([O-:38])=[O:39])[cH:40][cH:41]3)[CH2:28][CH2:29]2)[cH:19][cH:20][cH:21][cH:22][cH:23]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH2:14][O:15][C:30]([N:27]2[CH2:26][CH2:25][N:24]([c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[CH2:29][CH2:28]2)=[O:31])[O:11][CH2:12][CH2:13]1

참가 물질

6

출처 및 근거

ORD 기록
ord-593d7b16630140929aac0f354cc22c37
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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