Acetic Acid → HCID 15295463, compound

HRID 139494Notes

Reaction equation

HRID 139494 reaction equation
[CH3:25][C:26](=[O:27])[OH:28].[CH:1]1([CH2:6][c:7]2[cH:8][c:9]([CH:15]3[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]3)[cH:10][cH:11][c:12]2[O:13][CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5]1.[Na:21][O:22][C:23]#[N:24].[OH2:29]>>[CH:1]1([CH2:6][c:7]2[cH:8][c:9]([CH:15]3[CH2:16][CH2:17][N:18]([C:23](=[O:22])[NH2:24])[CH2:19][CH2:20]3)[cH:10][cH:11][c:12]2[O:13][CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 19379065HCID 19379065, compoundHCID 178418852HCID 178418852, compound

Product 1

HCID 15295463HCID 15295463, compound

Sources & evidence

ORD record
ord-08912f2920b5445b81cbd983ea6b6223
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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