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Hydrochloric Acid → 1,3-Dimethyl-7-[4-[4-(2-morpholinoethoxy)benzoyl]-benzyl]xanthine

HRID 199633
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HRID 199633 반응식
[C:30](=[O:31])([O-:32])[O-:33].[Cl:37][CH2:38][CH2:39][N:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[ClH:36].[K+:34].[K+:35].[O:46]=[CH:47][N:48]([CH3:49])[CH3:50].[OH2:51].[OH:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[c:8]2[cH:9][cH:10][c:11]([CH2:12][n:13]3[cH:14][n:15][c:16]4[n:17]([CH3:25])[c:18](=[O:24])[n:19]([CH3:23])[c:20](=[O:22])[c:21]34)[cH:26][cH:27]2)[cH:28][cH:29]1>>[O:1]([c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[c:8]2[cH:9][cH:10][c:11]([CH2:12][n:13]3[cH:14][n:15][c:16]4[n:17]([CH3:25])[c:18](=[O:24])[n:19]([CH3:23])[c:20](=[O:22])[c:21]34)[cH:26][cH:27]2)[cH:28][cH:29]1)[CH2:38][CH2:39][N:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 813Potassium Cation2회HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 767274-(2-Chloroethyl)morpholineHCID 189190737-[4-(4-Hydroxybenzoyl)benzyl)-1,3-dimethylxanthine

생성물 1

HCID 189193401,3-Dimethyl-7-[4-[4-(2-morpholinoethoxy)benzoyl]-benzyl]xanthine

출처 및 근거

ORD 기록
ord-6d3fcc95ca48454dbe9dfac9d3c68b9a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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