Acetic Acid → HCID 21914954, compound

HRID 1215492Notes

Reaction equation

HRID 1215492 reaction equation
[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([CH:9]=[CH:10][c:11]2[n:12][c:13]([NH:16][C:17]([CH3:18])=[O:19])[s:14][cH:15]2)[cH:7][cH:8]1.[C:20]([c:21]1[cH:22][cH:23][c:24]([CH:25]=[CH:26][c:27]2[n:28][c:29]([NH:30][C:31](=[O:32])[CH3:33])[s:34][cH:35]2)[cH:36][cH:37]1)#[N:38].[CH3:39][OH:40].[CH3:43][C:44](=[O:45])[OH:46].[H:41][H:42].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([CH2:9][CH2:10][c:11]2[n:12][c:13]([NH:16][C:17]([CH3:18])=[O:19])[s:14][cH:15]2)[cH:7][cH:8]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 887MethanolHCID 8028TetrahydrofuranHCID 73853130HCID 73853130, compound2×HCID 178418361HCID 178418361, compound

Product 1

HCID 21914954HCID 21914954, compound

Sources & evidence

ORD record
ord-6d8554f9eb474355bf2a2eb512524119
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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