Benzene → [2-(2,3-Dihydro-indol-1-yl)-2-oxo-ethyl]-phosphonic acid diethyl ester

HRID 167284

반응식

HRID 167284 반응식
[CH2:24]1[CH2:25][c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]2[NH:32]1.[CH2:46]1[O:47][CH2:48][CH2:49][CH2:50]1.[CH2:7]([CH3:8])[O:9][P:10](=[O:11])([O:12][CH2:13][CH3:14])[CH2:15][C:16](=[O:17])[OH:18].[CH3:19][N:20]([CH3:21])[CH:22]=[O:23].[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH2:7]([CH3:8])[O:9][P:10](=[O:11])([O:12][CH2:13][CH3:14])[CH2:15][C:16](=[O:18])[N:32]1[CH2:24][CH2:25][c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]21

참가 물질

8

출처 및 근거

ORD 기록
ord-1358c5cd2d3d42c7b421333eae2e843f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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