Ethanol → HCID 19994700, compound

HRID 2125996Notes

Reaction equation

HRID 2125996 reaction equation
[C:44](=[O:45])([OH:46])[O-:47].[CH3:49][CH2:50][OH:51].[Na+:48].[OH2:52].[OH:1][c:2]1[cH:3][c:4]([O:24][CH2:25][c:26]2[cH:27][cH:28][c:29]([O:32][CH2:33][c:34]3[n:35][c:36]4[cH:37][cH:38][cH:39][cH:40][c:41]4[cH:42][cH:43]3)[cH:30][cH:31]2)[cH:5][c:6]2[c:7]1[N:8]([c:16]1[cH:17][cH:18][c:19]([O:22][CH3:23])[cH:20][cH:21]1)[CH:9]([C:11](=[O:12])[O:13][CH2:14][CH3:15])[O:10]2>>[OH:1][c:2]1[cH:3][c:4]([O:24][CH2:25][c:26]2[cH:27][cH:28][c:29]([O:32][CH2:33][c:34]3[n:35][c:36]4[cH:37][cH:38][cH:39][cH:40][c:41]4[cH:42][cH:43]3)[cH:30][cH:31]2)[cH:5][c:6]2[c:7]1[N:8]([c:16]1[cH:17][cH:18][c:19]([O:22][CH3:23])[cH:20][cH:21]1)[CH:9]([C:11](=[O:12])[OH:13])[O:10]2

Participants

6

Reactant 5

HCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 19994704HCID 19994704, compound

Product 1

HCID 19994700HCID 19994700, compound

Sources & evidence

ORD record
ord-287c94d80b08485a8d74b275b4febb64
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…