Acetate → HCID 11222675, compound

HRID 200401Notes

Reaction equation

HRID 200401 reaction equation
[C:36](=[O:37])([OH:38])[O-:39].[CH3:1][C:2]([OH:3])=[O:4].[CH3:32][C:33](=[O:34])[O-:35].[ClH:5].[NH2:6][c:7]1[c:8]([C:9](=[O:10])[NH:11][c:12]2[cH:13][cH:14][c:15]([N:18]3[CH2:19][CH2:20][N:21]4[CH2:22][CH2:23][CH:24]3[CH2:25][CH2:26]4)[cH:16][cH:17]2)[cH:27][cH:28][cH:29][cH:30]1.[Na+:31].[Na+:40].[OH2:41]>>[CH3:1][C:2](=[O:3])[NH:6][c:7]1[c:8]([C:9](=[O:10])[NH:11][c:12]2[cH:13][cH:14][c:15]([N:18]3[CH2:19][CH2:20][N:21]4[CH2:22][CH2:23][CH:24]3[CH2:25][CH2:26]4)[cH:16][cH:17]2)[cH:27][cH:28][cH:29][cH:30]1

Participants

8

Reactant 7

HCID 175AcetateHCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 962WaterHCID 11450536HCID 11450536, compound

Product 1

HCID 11222675HCID 11222675, compound

Sources & evidence

ORD record
ord-64a6afbb97bc4fdea32e8eaf06463409
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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