Ethanol → HCID 66616329, compound

HRID 304902Notes

Reaction equation

HRID 304902 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH2:7][CH2:8][CH:9]([NH:12][c:13]2[n:14][cH:15][cH:16][c:17](-[c:19]3[cH:20][n:21][c:22]4[n:23]3[cH:24][cH:25][cH:26][c:27]4[O:28][CH2:29][CH2:30][CH2:31][S:32](=[O:33])(=[O:34])[CH3:35])[n:18]2)[CH2:10][CH2:11]1.[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:41][CH2:42][OH:43].[OH2:44]>>[O:3]=[C:4]([OH:5])[CH:6]1[CH2:7][CH2:8][CH:9]([NH:12][c:13]2[n:14][cH:15][cH:16][c:17](-[c:19]3[cH:20][n:21][c:22]4[n:23]3[cH:24][cH:25][cH:26][c:27]4[O:28][CH2:29][CH2:30][CH2:31][S:32](=[O:33])(=[O:34])[CH3:35])[n:18]2)[CH2:10][CH2:11]1

Participants

5

Reactant 4

HCID 702EthanolHCID 962WaterHCID 8028TetrahydrofuranHCID 66616479HCID 66616479, compound

Product 1

HCID 66616329HCID 66616329, compound

Sources & evidence

ORD record
ord-93746907f1a8413db5f7d25a37836b9b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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