Sodium ion → HCID 69521355, compound

HRID 662755Notes

Reaction equation

HRID 662755 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:45]2)[CH:20]=[C:21]([C:28](=[O:29])[NH:30][c:31]2[cH:32][cH:33][c:34]([S:37][CH2:38][c:39]4[n:40][n:41][cH:42][n:43]4[CH3:44])[cH:35][cH:36]2)[CH2:22][CH2:23][N:24]3[CH2:25][CH2:26][CH3:27])[cH:13][cH:14]1.[Cl:64][CH2:65][Cl:66].[Na+:62].[Na+:63].[OH:46][O:47][C:48]([c:49]1[cH:50][c:51]([Cl:52])[cH:53][cH:54][cH:55]1)=[O:56].[S:57]([O-:58])([O-:59])(=[O:60])=[S:61]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:45]2)[CH:20]=[C:21]([C:28](=[O:29])[NH:30][c:31]2[cH:32][cH:33][c:34]([S:37]([CH2:38][c:39]4[n:40][n:41][cH:42][n:43]4[CH3:44])=[O:46])[cH:35][cH:36]2)[CH2:22][CH2:23][N:24]3[CH2:25][CH2:26][CH3:27])[cH:13][cH:14]1

Participants

6

Sources & evidence

ORD record
ord-b42b63db535048eea011f714b226f1c5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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