Potassium Cation → HCID 68887116, compound

HRID 1201683Notes

Reaction equation

HRID 1201683 reaction equation
[CH2:53]([CH2:54][O:55][CH3:56])[O:57][CH3:58].[CH3:1][C:2]([CH3:3])([O-:4])[CH3:5].[CH3:20][c:21]1[n:22][c:23]([O:29][CH2:30][c:31]2[cH:32][cH:33][c:34]([O:37][CH2:38][c:39]3[n:40][c:41](-[c:45]4[cH:46][cH:47][cH:48][cH:49][cH:50]4)[o:42][c:43]3[CH3:44])[cH:35][cH:36]2)[c:24]([CH:25]=[O:26])[cH:27][cH:28]1.[CH3:51][OH:52].[K+:6].[OH2:59].[c:7]1([CH3:8])[c:9]([S:10](=[O:12])(=[O:13])[CH2:16][N+:17]#[C-:11])[cH:14][cH:15][cH:18][cH:19]1>>[C:16](#[N:17])[CH2:25][c:24]1[c:23]([O:29][CH2:30][c:31]2[cH:32][cH:33][c:34]([O:37][CH2:38][c:39]3[n:40][c:41](-[c:45]4[cH:46][cH:47][cH:48][cH:49][cH:50]4)[o:42][c:43]3[CH3:44])[cH:35][cH:36]2)[n:22][c:21]([CH3:20])[cH:28][cH:27]1

Participants

8

Reactant 7

HCID 813Potassium CationHCID 887MethanolHCID 962WaterHCID 80711,2-DimethoxyethaneHCID 45749132-Methylpropan-2-olateHCID 53627694Toluenesulfonylmethyl isocyanideHCID 86591565HCID 86591565, compound

Product 1

HCID 68887116HCID 68887116, compound

Sources & evidence

ORD record
ord-c7454873f3dc49de8778c24e6fb37402
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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