Ethanol → HCID 9847137, compound

HRID 1142741Notes

Reaction equation

HRID 1142741 reaction equation
[C:35]([CH3:36])(=[S:37])[O-:38].[C:43]([O:44][CH2:45][CH3:46])(=[O:47])[CH3:48].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH2:9][CH:10]1[CH:11]([O:30][S:31]([CH3:32])(=[O:33])=[O:34])[CH2:12][C:13](=[O:29])[N:14]1[CH2:15][c:16]1[cH:17][cH:18][c:19]([O:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:20][cH:21]1.[CH3:40][CH2:41][OH:42].[CH3:49][CH2:50][CH2:51][CH2:52][CH2:53][CH3:54].[K+:39]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH2:9][CH:10]1[CH:11]([S:37][C:35]([CH3:36])=[O:38])[CH2:12][C:13](=[O:29])[N:14]1[CH2:15][c:16]1[cH:17][cH:18][c:19]([O:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:20][cH:21]1

Participants

7

Reactant 6

HCID 702EthanolHCID 813Potassium CationHCID 8058HexaneHCID 8857Ethyl AcetateHCID 22293000HCID 22293000, compoundHCID 178476994HCID 178476994, compound

Product 1

HCID 9847137HCID 9847137, compound

Sources & evidence

ORD record
ord-916d9d9800af4de5b1d32ef663dc6d8f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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