Citric Acid → HCID 23146858, compound

HRID 297739Notes

Reaction equation

HRID 297739 reaction equation
[CH3:25][C:26]([CH3:27])([O-:28])[CH3:29].[CH3:46][CH2:47][OH:48].[Na+:30].[Na+:32].[OH-:31].[OH2:49].[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]1([CH:7]2[CH2:8][N:9]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:10][CH2:11][CH:12]2[C:13](=[O:14])[O:15][CH2:16][CH3:17])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[CH2:8][N:9]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:10][CH2:11][CH:12]2[C:13](=[O:14])[OH:15])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

8

Reactant 7

HCID 311Citric AcidHCID 702EthanolHCID 923Sodium ion2×HCID 961HydroxideHCID 962WaterHCID 45749132-Methylpropan-2-olateHCID 68474352HCID 68474352, compound

Product 1

HCID 23146858HCID 23146858, compound

Sources & evidence

ORD record
ord-8e89b206f2f7454c841b81ef9206fdab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…