Acetic Acid → HCID 10602929, compound

HRID 109182Notes

Reaction equation

HRID 109182 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:16]2[S:17][CH2:18][C:19](=[O:38])[N:20]2[CH2:21][CH2:22][CH2:23][N:24]([CH2:25][CH2:26][O:27][c:28]2[cH:29][c:30]3[c:31]([cH:32][cH:33]2)[O:34][CH2:35][O:36]3)[CH3:37])[cH:8][c:9]([C:12]([CH3:13])([CH3:14])[CH3:15])[c:10]1[OH:11].[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[CH3:53][C:54](=[O:55])[OH:56].[Na+:47].[Na+:48].[O-:49][C:50](=[O:51])[O-:52].[OH:39][OH:40]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:16]2[S:17](=[O:43])[CH2:18][C:19](=[O:38])[N:20]2[CH2:21][CH2:22][CH2:23][N:24]([CH2:25][CH2:26][O:27][c:28]2[cH:29][c:30]3[c:31]([cH:32][cH:33]2)[O:34][CH2:35][O:36]3)[CH3:37])[cH:8][c:9]([C:12]([CH3:13])([CH3:14])[CH3:15])[c:10]1[OH:11]

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 784Hydrogen PeroxideHCID 923Sodium ion2×HCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 9850335HCID 9850335, compound

Product 1

HCID 10602929HCID 10602929, compound

Sources & evidence

ORD record
ord-6ff87daac20f422ba34e79d134bc6de5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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