Benzoic Acid → HCID 72322199, 화합물

HRID 298145노트

반응식

HRID 298145 반응식
[C:2](#[N:3])[C:4]1([NH:7][C:8](=[O:9])[CH:10]2[NH:11][CH2:12][CH:13]([S:15](=[O:16])(=[O:17])[c:18]3[c:19]([Cl:24])[cH:20][cH:21][cH:22][cH:23]3)[CH2:14]2)[CH2:5][CH2:6]1.[ClH:1].[OH:25][C:26](=[O:27])[c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[C:2](#[N:3])[C:4]1([NH:7][C:8](=[O:9])[CH:10]2[N:11]([C:26](=[O:25])[c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[CH2:12][CH:13]([S:15](=[O:16])(=[O:17])[c:18]3[c:19]([Cl:24])[cH:20][cH:21][cH:22][cH:23]3)[CH2:14]2)[CH2:5][CH2:6]1

참가 물질

4

출처 및 근거

ORD 기록
ord-2a12f87b7e6f42799b20d9f07a68b9d7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

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