Toluene → HCID 86622467, 화합물

HRID 135678

반응식

HRID 135678 반응식
[CH2:5]([O:6][C:8]([c:9]1[cH:10][n:11][cH:12][c:13]([C:15]#[C:16][c:17]2[cH:18][c:19]([F:23])[cH:20][cH:21][cH:22]2)[cH:14]1)=[O:24])[CH3:7].[CH3:1][Al:2]([CH3:3])[CH3:4].[CH3:25][NH:26][O:27][CH3:28].[CH3:29][CH2:30][O:31][C:32](=[O:33])[CH3:34].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1>>[C:8]([c:9]1[cH:10][n:11][cH:12][c:13]([C:15]#[C:16][c:17]2[cH:18][c:19]([F:23])[cH:20][cH:21][cH:22]2)[cH:14]1)(=[O:24])[N:26]([CH3:25])[O:27][CH3:28]

참가 물질

6

출처 및 근거

ORD 기록
ord-bc2ecb68eed44839b7de7d70f5818da8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

불러오는 중…