Methanol → HCID 178453359, 화합물

HRID 1234173

반응식

HRID 1234173 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([CH2:9][CH2:10][CH2:11][c:12]1[cH:13][cH:14][c:15](-[c:18]2[cH:19][c:20]([O:28][CH:29]3[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]3)[c:21]([C:24](=[O:25])[O:26][CH3:27])[cH:22][cH:23]2)[cH:16][cH:17]1)[CH2:35][CH:36]([c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)[OH:43].[CH3:46][OH:47].[Na+:45].[OH-:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([CH2:9][CH2:10][CH2:11][c:12]1[cH:13][cH:14][c:15](-[c:18]2[cH:19][c:20]([O:28][CH:29]3[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]3)[c:21]([C:24](=[O:25])[OH:26])[cH:22][cH:23]2)[cH:16][cH:17]1)[CH2:35][CH:36]([c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)[OH:43]

참가 물질

5

반응물 4

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 178497470methyl 2-cyclohexyloxy-4-[4-[3-[(2-hydroxy-2-phenylethyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]propyl]phenyl]benzoate

생성물 1

HCID 178453359HCID 178453359, 화합물

출처 및 근거

ORD 기록
ord-59ead7b9d91e4d3987b4791e4e2b5213
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

연결된 노트

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