Citric Acid → HCID 178431248, compound

HRID 110055

Reaction equation

HRID 110055 reaction equation
[CH2:32]([O:33][CH:34]1[CH:35]=[CH:36][c:37]2[c:38]([cH:39][cH:40][cH:41][cH:42]2)[N:43]1[C:44]([O:45][CH2:46][CH3:47])=[O:48])[CH3:49].[CH3:24][C:25]([C:26](=[O:27])[NH:28][NH2:29])([CH3:30])[CH3:31].[Cl:1][c:2]1[c:3]2[n:4][cH:5][n:6]([CH:11]3[O:12][CH:13]([C:21](=[O:22])[OH:23])[CH:14]4[CH:15]3[O:16][C:17]([CH3:19])([CH3:20])[O:18]4)[c:7]2[n:8][cH:9][n:10]1.[OH:50][C:51]([CH2:52][C:53]([C:54](=[O:55])[OH:56])([CH2:57][C:58](=[O:59])[OH:60])[OH:61])=[O:62]>>[Cl:1][c:2]1[c:3]2[n:4][cH:5][n:6]([CH:11]3[O:12][CH:13]([C:21](=[O:22])[NH:29][NH:28][C:26]([C:25]([CH3:24])([CH3:30])[CH3:31])=[O:27])[CH:14]4[CH:15]3[O:16][C:17]([CH3:19])([CH3:20])[O:18]4)[c:7]2[n:8][cH:9][n:10]1

Participants

5

Reactant 4

HCID 311Citric AcidHCID 278332-Ethoxy-1-(ethoxycarbonyl)-1,2-dihydroquinolineHCID 5451472,2-DimethylpropanehydrazideHCID 14374714(3aS,4S,6R,6aR)-6-(6-chloro-9H-purin-9-yl)-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxole-4-carboxylic acid

Product 1

HCID 178431248HCID 178431248, compound

Sources & evidence

ORD record
ord-2a368a11650c4656a4ca5f5fecf60d58
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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