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Hydrochloric Acid → Hydrochloric Acid

HRID 1551697
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HRID 1551697 반응식
[C:1]([O:2][C:3](=[O:4])[NH:7][CH2:8][c:9]1[n:10][cH:11][c:12]([C:23]([N:24]([CH2:25][CH2:26][c:27]2[n:28][cH:29][cH:30][cH:31][cH:32]2)[CH3:33])=[O:34])[c:13]2[cH:14][c:15]([O:21][CH3:22])[cH:16][c:17]([O:19][CH3:20])[c:18]12)([CH3:5])([CH3:6])[CH3:35].[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[ClH:36]>>[ClH:36].[NH2:7][CH2:8][c:9]1[n:10][cH:11][c:12]([C:23]([N:24]([CH2:25][CH2:26][c:27]2[n:28][cH:29][cH:30][cH:31][cH:32]2)[CH3:33])=[O:34])[c:13]2[cH:14][c:15]([O:21][CH3:22])[cH:16][c:17]([O:19][CH3:20])[c:18]12
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반응물 3

HCID 313Hydrochloric AcidHCID 8857Ethyl AcetateHCID 68613832{6,8-Dimethoxy-4-[methyl-(2-pyridin-2-yl-ethyl)-carbamoyl]-isoquinolin-1-ylmethyl}-carbamic acid tert-butyl ester

생성물 2

HCID 313Hydrochloric AcidHCID 468469381-(aminomethyl)-6,8-dimethoxy-N-methyl-N-(2-pyridin-2-ylethyl)isoquinoline-4-carboxamide

출처 및 근거

ORD 기록
ord-67cae69b9b72437681d0ccc9310f4546
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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