Acetic Acid → HCID 67441367, compound

HRID 1144880Notes

Reaction equation

HRID 1144880 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[NH:12][CH:11]([c:16]1[cH:17][c:18]([NH:22][CH3:23])[cH:19][cH:20][cH:21]1)[C:10]([CH3:24])([CH3:25])[CH2:9]2.[CH3:30][C:31](=[O:32])[OH:33].[Na:26][O:27][C:28]#[N:29].[OH2:34]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[NH:12][CH:11]([c:16]1[cH:17][c:18]([N:22]([CH3:23])[C:28](=[O:27])[NH2:29])[cH:19][cH:20][cH:21]1)[C:10]([CH3:24])([CH3:25])[CH2:9]2

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 67443130HCID 67443130, compoundHCID 178418852HCID 178418852, compound

Product 1

HCID 67441367HCID 67441367, compound

Sources & evidence

ORD record
ord-9e6307735eea4718aa21b69ce9b61ce3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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