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Dimethyl Sulfoxide → 2-{4-[4-amino-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl}acetaldehyde

HRID 1235134
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HRID 1235134 반응식
[C:50](=[O:51])([OH:52])[O-:53].[CH3:1][S:2]([CH3:3])=[O:4].[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[Cl:55][CH2:56][Cl:57].[Cl:5][C:6]([C:7]([Cl:8])=[O:9])=[O:10].[NH2:11][c:12]1[c:13]2[c:14]([n:15][cH:16][n:17]1)[n:18]([CH:34]1[CH2:35][CH2:36][CH:37]([CH2:40][CH2:41][OH:42])[CH2:38][CH2:39]1)[cH:19][c:20]2-[c:21]1[cH:22][cH:23][c:24]([O:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:25][cH:26]1.[Na+:54]>>[NH2:11][c:12]1[c:13]2[c:14]([n:15][cH:16][n:17]1)[n:18]([CH:34]1[CH2:35][CH2:36][CH:37]([CH2:40][CH:41]=[O:42])[CH2:38][CH2:39]1)[cH:19][c:20]2-[c:21]1[cH:22][cH:23][c:24]([O:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:25][cH:26]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 679Dimethyl SulfoxideHCID 769Bicarbonate IonHCID 923Sodium IonHCID 6344DichloromethaneHCID 8471TriethylamineHCID 65578Oxalyl chlorideHCID 227362622-{4-[4-amino-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl}-1-ethanol

생성물

1
HCID 227361722-{4-[4-amino-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl}acetaldehyde

출처 및 근거

ORD 기록
ord-951ea41de3654b36b5ce304f559c0829
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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