Acetic Acid → HCID 18378545, compound

HRID 2137753Notes

Reaction equation

HRID 2137753 reaction equation
[C:42]([OH:43])(=[O:44])[CH3:45].[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:6])[NH:7][c:8]2[cH:9][cH:10][cH:11][c:12]3[nH:13][c:14]([CH3:17])[n:15][c:16]23)[cH:18][cH:19][c:20]([C:22](=[O:23])[N:24]2[CH2:25][CH2:26][CH2:27][S:28][c:29]3[c:30]2[cH:31][cH:32][cH:33][cH:34]3)[cH:21]1.[Na+:41].[O-:37][C:38]([OH:39])=[O:40].[OH:35][OH:36]>>[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:6])[NH:7][c:8]2[cH:9][cH:10][cH:11][c:12]3[nH:13][c:14]([CH3:17])[n:15][c:16]23)[cH:18][cH:19][c:20]([C:22](=[O:23])[N:24]2[CH2:25][CH2:26][CH2:27][S:28](=[O:37])[c:29]3[c:30]2[cH:31][cH:32][cH:33][cH:34]3)[cH:21]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 784Hydrogen PeroxideHCID 923Sodium ionHCID 9869415HCID 9869415, compound

Product 1

HCID 18378545HCID 18378545, compound

Sources & evidence

ORD record
ord-f7f104fe81ec40c1b5a4719390ab6137
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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