Citric Acid → HCID 66673079, compound

HRID 296598Notes

Reaction equation

HRID 296598 reaction equation
[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH2:7]([Li:8])[CH2:9][CH2:10][CH3:11].[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH3:6].[N:12]1([c:19]2[c:20]3[c:21]([n:22][c:23](-[c:25]4[c:26]([F:33])[cH:27][c:28]([Cl:32])[c:29]([F:31])[cH:30]4)[n:24]2)[cH:34][cH:35][s:36]3)[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]1.[OH:37][C:38](=[O:39])[CH2:40][C:41]([C:42](=[O:43])[OH:44])([CH2:45][C:46](=[O:47])[OH:48])[OH:49]>>[N:12]1([c:19]2[c:20]3[c:21]([n:22][c:23](-[c:25]4[c:26]([F:33])[cH:27][c:28]([Cl:32])[c:29]([F:31])[cH:30]4)[n:24]2)[cH:34][c:35]([C:38](=[O:37])[OH:39])[s:36]3)[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]1

Participants

6

Reactant 5

HCID 311Citric AcidHCID 8028TetrahydrofuranHCID 8058HexaneHCID 66674077HCID 66674077, compoundHCID 178418339Butyllithium

Product 1

HCID 66673079HCID 66673079, compound

Sources & evidence

ORD record
ord-c0bc8965a88d463193d8ca6e4baf10e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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