Acetic Acid → HCID 19894546, compound

HRID 2344437Notes

Reaction equation

HRID 2344437 reaction equation
[C:1](=[O:2])([CH3:3])[O:4][c:5]1[c:6]([CH3:36])[c:7]([CH3:35])[c:8]2[c:9]([c:33]1[CH3:34])[CH2:10][CH2:11][C:12]([CH3:14])([CH2:15][C:16](=[O:17])[N:18]1[CH2:19][CH2:20][N:21]([c:24]3[n:25][cH:26][cH:27][cH:28][c:29]3[NH:30][CH2:31][CH3:32])[CH2:22][CH2:23]1)[O:13]2.[C:37](=[O:38])([O-:39])[O-:40].[CH3:43][C:44](=[O:45])[OH:46].[CH3:47][OH:48].[K+:41].[K+:42]>>[OH:4][c:5]1[c:6]([CH3:36])[c:7]([CH3:35])[c:8]2[c:9]([c:33]1[CH3:34])[CH2:10][CH2:11][C:12]([CH3:14])([CH2:15][C:16](=[O:17])[N:18]1[CH2:19][CH2:20][N:21]([c:24]3[n:25][cH:26][cH:27][cH:28][c:29]3[NH:30][CH2:31][CH3:32])[CH2:22][CH2:23]1)[O:13]2

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 813Potassium Cation2×HCID 887MethanolHCID 19660Carbonate IonHCID 19894535HCID 19894535, compound

Product 1

HCID 19894546HCID 19894546, compound

Sources & evidence

ORD record
ord-f7dea4ec0dea444fa7a61553497f9e4b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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