Ethanol → HCID 178488600, compound

HRID 2152976Notes

Reaction equation

HRID 2152976 reaction equation
[CH2:4]([O:6][C:7](=[O:5])[C:8]([CH2:9][CH2:10][CH2:11][NH:12][CH:13]1[CH:14]([OH:22])[CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]21)=[CH:23][c:24]1[cH:25][c:26]([O:36][CH3:37])[c:27](-[n:30]2[cH:31][n:32][c:33]([CH3:35])[cH:34]2)[cH:28][cH:29]1)[CH3:38].[CH3:1][CH2:2][OH:3].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[Na+:40].[OH-:39].[OH2:41]>>[O:6]=[C:7]1[C:8](=[CH:23][c:24]2[cH:25][c:26]([O:36][CH3:37])[c:27](-[n:30]3[cH:31][n:32][c:33]([CH3:35])[cH:34]3)[cH:28][cH:29]2)[CH2:9][CH2:10][CH2:11][N:12]1[CH:13]1[CH:14]([OH:22])[CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]21

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8857Ethyl AcetateHCID 178470955HCID 178470955, compound

Product 1

HCID 178488600HCID 178488600, compound

Sources & evidence

ORD record
ord-37158227e41c4db8af14133e061fcb56
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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