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Hydrochloric Acid → HCID 178490385, 화합물

HRID 665977
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HRID 665977 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[OH:12])[CH2:13][c:14]1[cH:15][cH:16][c:17]([O:20][CH3:21])[cH:18][cH:19]1.[CH2:30]([c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[O:37][C:38]([CH2:39][NH:40][CH2:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)=[O:48].[CH3:22][CH2:23][N:24]([CH2:25][CH3:26])[CH2:27][CH3:28].[Cl:50][c:51]1[cH:52][cH:53][cH:54][cH:55][n+:56]1[CH3:57].[Cl:58][CH2:59][Cl:60].[ClH:29].[I-:49]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:12])[N:40]([CH2:39][C:38]([O:37][CH2:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)=[O:48])[CH2:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)[CH2:13][c:14]1[cH:15][cH:16][c:17]([O:20][CH3:21])[cH:18][cH:19]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 30165Iodide IonHCID 1670702-Chloro-1-methylpyridiniumHCID 41264752-((tert-Butoxycarbonyl)amino)-3-(4-methoxyphenyl)propanoic acidHCID 13893872HCID 13893872, 화합물

생성물

1
HCID 178490385HCID 178490385, 화합물

출처 및 근거

ORD 기록
ord-ca585ee1fcd94300a0b09f587d141ccb
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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