Citric Acid → HCID 15745338, compound

HRID 2325969Notes

Reaction equation

HRID 2325969 reaction equation
[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[CH:1]1([CH2:4][N:5]2[CH2:6][CH:7]3[CH2:8][NH:9][CH2:10][CH:11]([CH2:12]2)[C:13]3([CH3:14])[CH3:15])[CH2:2][CH2:3]1.[F:18][c:19]1[cH:20][cH:21][c:22]([CH:25]([c:26]2[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]2)[Cl:33])[cH:23][cH:24]1.[Li:16].[NH2-:17].[OH:34][C:35]([CH2:36][C:37]([C:38](=[O:39])[OH:40])([CH2:41][C:42](=[O:43])[OH:44])[OH:45])=[O:46]>>[CH:1]1([CH2:4][N:5]2[CH2:6][CH:7]3[CH2:8][N:9]([CH:25]([c:22]4[cH:21][cH:20][c:19]([F:18])[cH:24][cH:23]4)[c:26]4[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]4)[CH2:10][CH:11]([CH2:12]2)[C:13]3([CH3:14])[CH3:15])[CH2:2][CH2:3]1

Participants

7

Reactant 6

HCID 311Citric AcidHCID 6228DimethylformamideHCID 27237731,1'-(Chloromethylene)bis(4-fluorobenzene)HCID 2826723AzanideHCID 3028194LithiumHCID 14403133HCID 14403133, compound

Product 1

HCID 15745338HCID 15745338, compound

Sources & evidence

ORD record
ord-1d2eb9c19b6d4e26af6c9eddad17456b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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