Ethanol → HCID 57246917, compound

HRID 1117839Notes

Reaction equation

HRID 1117839 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH2:6][N:7]([c:8]1[cH:9][c:10]2[c:11]([n:12]([CH3:32])[c:13]([CH2:15][c:16]3[cH:17][cH:18][c:19]([C:20](=[N:21][C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[NH2:29])[cH:30][cH:31]3)[n:14]2)[cH:33][cH:34]1)[S:35](=[O:36])(=[O:37])[c:38]1[cH:39][cH:40][cH:41][c:42]2[cH:43][cH:44][cH:45][n:46][c:47]12.[CH3:50][CH2:51][OH:52].[Na+:49].[OH-:48]>>[O:3]=[C:4]([OH:5])[CH2:6][N:7]([c:8]1[cH:9][c:10]2[c:11]([n:12]([CH3:32])[c:13]([CH2:15][c:16]3[cH:17][cH:18][c:19]([C:20](=[N:21][C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[NH2:29])[cH:30][cH:31]3)[n:14]2)[cH:33][cH:34]1)[S:35](=[O:36])(=[O:37])[c:38]1[cH:39][cH:40][cH:41][c:42]2[cH:43][cH:44][cH:45][n:46][c:47]12

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 57169230HCID 57169230, compound

Product 1

HCID 57246917HCID 57246917, compound

Sources & evidence

ORD record
ord-19e7a32c84f2405eae14bf865c9b39b5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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