Acetic Acid → HCID 178487848, compound

HRID 102051Notes

Reaction equation

HRID 102051 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([CH2:13][CH2:14][CH2:15][CH:16]3[CH:17]([C:31](=[O:32])[O:33][CH3:34])[CH2:18][N:19]([CH2:22][CH2:23][S:24][c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[CH2:20][CH2:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][cH:12]1.[CH3:37][C:38](=[O:39])[OH:40].[CH3:41][OH:42].[Na+:36].[OH-:35]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([CH2:13][CH2:14][CH2:15][CH:16]3[CH:17]([C:31](=[O:32])[OH:33])[CH2:18][N:19]([CH2:22][CH2:23][S:24][c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[CH2:20][CH2:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][cH:12]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 178498815HCID 178498815, compound

Product 1

HCID 178487848HCID 178487848, compound

Sources & evidence

ORD record
ord-bab35efa978947dc9a8a1072cb1f87bc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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