Citric Acid → HCID 178430768, compound

HRID 302378

Reaction equation

HRID 302378 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]2[CH2:11][c:12]3[cH:13][cH:14][c:15]([Br:22])[n:16][c:17]3[N:18]2[CH:19]([CH3:21])[CH2:20]1.[C:23]([Li:24])([CH3:25])([CH3:26])[CH3:27].[CH3:28][N:29]([CH:30]=[O:31])[CH3:32].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[OH:33][C:34]([CH2:35][C:36]([C:37](=[O:38])[OH:39])([CH2:40][C:41](=[O:42])[OH:43])[OH:44])=[O:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]2[CH2:11][c:12]3[cH:13][cH:14][c:15]([CH:30]=[O:31])[n:16][c:17]3[N:18]2[CH:19]([CH3:21])[CH2:20]1

Participants

6

Reactant 5

HCID 311Citric AcidHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 87797446Tert-butyl 4-bromo-13-methyl-1,3,11-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5-triene-11-carboxylateHCID 178418306HCID 178418306, compound

Product 1

HCID 178430768HCID 178430768, compound

Sources & evidence

ORD record
ord-d5a98f633fec4179ac8e7533fe1fe008
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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