Ethanol → HCID 22283177, compound

HRID 1236201Notes

Reaction equation

HRID 1236201 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([N:39]2[CH2:40][CH2:41][O:42][CH2:43][CH2:44]2)[c:7]2[c:8]1[n:9][c:10]([NH:12][C:13](=[O:14])[c:15]1[cH:16][cH:17][c:18]([CH2:19][N:20]([CH2:21][CH2:22][O:23][C:24](=[O:25])[c:26]3[cH:27][cH:28][c:29]([O:30][CH3:31])[c:32]([O:33][CH3:34])[cH:35]3)[CH3:36])[cH:37][cH:38]1)[s:11]2.[CH3:45][CH2:46][OH:47].[Na+:49].[OH-:48].[OH2:50]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([N:39]2[CH2:40][CH2:41][O:42][CH2:43][CH2:44]2)[c:7]2[c:8]1[n:9][c:10]([NH:12][C:13](=[O:14])[c:15]1[cH:16][cH:17][c:18]([CH2:19][N:20]([CH2:21][CH2:22][OH:23])[CH3:36])[cH:37][cH:38]1)[s:11]2

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 86584921HCID 86584921, compound

Product 1

HCID 22283177HCID 22283177, compound

Sources & evidence

ORD record
ord-e9cf007c676f4d31b07811decce29906
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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