Ethanol → HCID 66726076, compound

HRID 2323285Notes

Reaction equation

HRID 2323285 reaction equation
[CH2:1]([CH3:2])[CH:3]([C:4](=[O:5])[O-:6])[CH:7]1[CH2:8][N:9]=[C:10]([c:12]2[nH:13][c:14]3[c:15]([O:32][CH:33]4[CH2:34][CH2:35][O:36][CH2:37][CH2:38]4)[cH:16][c:17]([O:21][c:22]4[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:26][cH:27]4)[cH:18][c:19]3[cH:20]2)[S:11]1.[CH3:46][CH2:47][OH:48].[Na+:40].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[OH-:39]>>[CH2:3]([C:4](=[O:5])[OH:6])[CH:7]1[CH2:8][N:9]=[C:10]([c:12]2[nH:13][c:14]3[c:15]([O:32][CH:33]4[CH2:34][CH2:35][O:36][CH2:37][CH2:38]4)[cH:16][c:17]([O:21][c:22]4[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:26][cH:27]4)[cH:18][c:19]3[cH:20]2)[S:11]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 178454661HCID 178454661, compound

Product 1

HCID 66726076HCID 66726076, compound

Sources & evidence

ORD record
ord-77e263fbdfc24f05920fcd21dd669d34
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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