Water → HCID 70999245, 화합물

HRID 2346757노트

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HRID 2346757 반응식
[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:52][C:53]#[N:54].[Cl:41][C:42](=[O:43])[c:44]1[cH:45][cH:46][c:47]([Cl:48])[cH:49][cH:50]1.[NH2:12][CH:13]1[CH:14]([c:26]2[cH:27][c:28]([Cl:33])[c:29]([Cl:32])[cH:30][cH:31]2)[CH2:15][N:16]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:17][CH2:18]1.[OH2:51].[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1>>[NH:12]([CH:13]1[CH:14]([c:26]2[cH:27][c:28]([Cl:33])[c:29]([Cl:32])[cH:30][cH:31]2)[CH2:15][N:16]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH2:17][CH2:18]1)[C:42](=[O:43])[c:44]1[cH:45][cH:46][c:47]([Cl:48])[cH:49][cH:50]1

참가 물질

7

출처 및 근거

ORD 기록
ord-7e4874d0b581483c8842ab4c5344aada
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

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