Acetic Acid → HCID 20338038, compound

HRID 2328619Notes

Reaction equation

HRID 2328619 reaction equation
[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[CH3:47][C:48](=[O:49])[OH:50].[CH:21]1([N:27]=[C:22]=[N:23][CH:24]2[CH2:25][CH2:26][CH2:28][CH2:29][CH2:30]2)[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]1.[CH:36]([Cl:37])([Cl:38])[Cl:39].[NH3:40].[n:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1[S:10][c:9]1[c:8]([cH:15][cH:14][c:13]([CH:16]([C:17](=[O:18])[OH:19])[CH3:20])[cH:12]1)[CH2:7][CH2:6]2>>[n:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1[S:10][c:9]1[c:8]([cH:15][cH:14][c:13]([CH:16]([C:17](=[O:18])[NH2:27])[CH3:20])[cH:12]1)[CH2:7][CH2:6]2

Participants

7

Sources & evidence

ORD record
ord-7ee5c41045004a6180967c11ec20ede5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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