Citric Acid → HCID 18333007, compound

HRID 296344Notes

Reaction equation

HRID 296344 reaction equation
[CH3:17][NH:18][CH3:19].[CH3:43][C:44]#[N:45].[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[Cl:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[NH:8][C:7](=[O:12])[CH:6]([C:13](=[O:14])[OH:15])[CH2:5]2.[ClH:16].[OH:20][n:21]1[c:22]2[c:23]([cH:24][cH:25][cH:26][cH:27]2)[n:28][n:29]1.[OH:30][C:31]([CH2:32][C:33]([C:34](=[O:35])[OH:36])([CH2:37][C:38](=[O:39])[OH:40])[OH:41])=[O:42]>>[Cl:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[NH:8][C:7](=[O:12])[CH:6]([C:13](=[O:15])[N:18]([CH3:17])[CH3:19])[CH2:5]2

Participants

8

Reactant 7

HCID 311Citric AcidHCID 313Hydrochloric AcidHCID 674DimethylamineHCID 6342AcetonitrileHCID 8471TriethylamineHCID 757711-HydroxybenzotriazoleHCID 18333062HCID 18333062, compound

Product 1

HCID 18333007HCID 18333007, compound

Sources & evidence

ORD record
ord-f897e53b457a4f9899ae49107a4d48d3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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