Acetic Acid → HCID 20186772, compound

HRID 2346956Notes

Reaction equation

HRID 2346956 reaction equation
[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[CH3:44][C:45](=[O:46])[OH:47].[H:36][H:37].[NH2:1][C:2](=[O:3])[CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]([CH2:12][CH:13]([CH3:14])[NH:15][CH2:16][CH:17]([O:18][CH2:19][CH2:20][OH:21])[c:22]2[cH:23][cH:24][c:25]([O:28][CH2:29][c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[cH:26][cH:27]2)[cH:10][cH:11]1>>[NH2:1][C:2](=[O:3])[CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]([CH2:12][CH:13]([CH3:14])[NH:15][CH2:16][CH:17]([O:18][CH2:19][CH2:20][OH:21])[c:22]2[cH:23][cH:24][c:25]([OH:28])[cH:26][cH:27]2)[cH:10][cH:11]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 8857Ethyl AcetateHCID 20186756HCID 20186756, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 20186772HCID 20186772, compound

Sources & evidence

ORD record
ord-63c2d2ebe4564d3dac77119b384ca6fc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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