Sodium ion → HCID 69521329, compound

HRID 141368Notes

Reaction equation

HRID 141368 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:48]2)[CH:20]=[C:21]([C:28](=[O:29])[NH:30][c:31]2[cH:32][cH:33][c:34]([S:37][CH2:38][CH2:39][c:40]4[n:41][n:42][cH:43][n:44]4[CH2:45][CH2:46][CH3:47])[cH:35][cH:36]2)[CH2:22][CH2:23][N:24]3[CH2:25][CH2:26][CH3:27])[cH:13][cH:14]1.[Cl:67][CH2:68][Cl:69].[Na+:65].[Na+:66].[OH:49][O:50][C:51]([c:52]1[cH:53][c:54]([Cl:55])[cH:56][cH:57][cH:58]1)=[O:59].[S:60]([O-:61])([O-:62])(=[O:63])=[S:64]>>[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:48]2)[CH:20]=[C:21]([C:28](=[O:29])[NH:30][c:31]2[cH:32][cH:33][c:34]([S:37]([CH2:38][CH2:39][c:40]4[n:41][n:42][cH:43][n:44]4[CH2:45][CH2:46][CH3:47])=[O:49])[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-39c17eb0bfe045ea96213c11b503b6ce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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