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Hydrochloric Acid → Hydrochloric Acid

HRID 1202976
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HRID 1202976 반응식
[CH3:14][NH:15][CH2:16][c:17]1[cH:18][cH:19][c:20]2[c:21]([cH:22][cH:23][cH:24][cH:25]2)[c:26]1[CH2:27][CH2:28][CH3:29].[CH3:1][NH:2][CH2:3][c:4]1[o:5][c:6]2[c:7]([c:8]1[CH3:9])[cH:10][cH:11][cH:12][cH:13]2.[ClH:30].[O:31]1[CH2:32][CH2:33][N:34]([CH2:37][CH2:38][N:39]2[C:40](=[O:54])[NH:41][c:42]3[c:43]([cH:45][c:46]([CH:49]=[CH:50][C:51](=[O:52])[OH:53])[cH:47][n:48]3)[CH2:44]2)[CH2:35][CH2:36]1>>[CH3:1][N:2]([CH2:3][c:4]1[o:5][c:6]2[c:7]([c:8]1[CH3:9])[cH:10][cH:11][cH:12][cH:13]2)[C:51]([CH:50]=[CH:49][c:46]1[cH:45][c:43]2[c:42]([n:48][cH:47]1)[NH:41][C:40](=[O:54])[N:39]([CH2:38][CH2:37][N:34]1[CH2:33][CH2:32][O:31][CH2:36][CH2:35]1)[CH2:44]2)=[O:52].[ClH:30]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 313Hydrochloric AcidHCID 46785639N-methyl-1-(3-methylbenzofuran-2-yl)methanamineHCID 59456959Methyl-(1-propyl-naphthalen-2-ylmethyl)amineHCID 669675133-[3-(2-Morpholin-4-ylethyl)-2-oxo-1,4-dihydropyrido[2,3-d]pyrimidin-6-yl]prop-2-enoic acid

생성물 2

HCID 313Hydrochloric Acid
HCID 66967535
N-methyl-N-[(3-methyl-1-benzofuran-2-yl)methyl]-3-[3-(2-morpholin-4-ylethyl)-2-oxo-1,4-dihydropyrido[2,3-d]pyrimidin-6-yl]prop-2-enamide

출처 및 근거

ORD 기록
ord-9d44742b11c446b4b0601c19b8f62983
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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