Citric Acid → 2-{1-[(Tert-butoxy)carbonyl]piperidin-4-yl}-1,3-oxazole-4-carboxylic acid

HRID 2340263노트

반응식

HRID 2340263 반응식
[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6][c:7]([CH:10]2[CH2:11][CH2:12][N:13]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:14][CH2:15]2)[o:8][cH:9]1.[CH3:46][CH2:47][O:48][CH2:49][CH3:50].[Cl-:45].[Na+:25].[Na+:44].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH-:24].[OH2:23].[OH:26][C:27]([CH2:28][C:29]([C:30](=[O:31])[OH:32])([CH2:33][C:34](=[O:35])[OH:36])[OH:37])=[O:38]>>[O:2]=[C:3]([OH:4])[c:5]1[n:6][c:7]([CH:10]2[CH2:11][CH2:12][N:13]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:14][CH2:15]2)[o:8][cH:9]1

참가 물질

9

출처 및 근거

ORD 기록
ord-d5539b222b60447d9a1d1e88a58f79b0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

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