Sodium ion → HCID 69523005, compound

HRID 281732Notes

Reaction equation

HRID 281732 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:49]2)[CH:20]=[C:21]([C:29](=[O:30])[NH:31][c:32]2[cH:33][c:34]([CH3:48])[c:35]([S:38][CH2:39][c:40]4[n:41][n:42][cH:43][n:44]4[CH2:45][CH2:46][CH3:47])[cH:36][cH:37]2)[CH2:22][CH2:23][N:24]3[CH2:25][CH:26]([CH3:27])[CH3:28])[cH:13][cH:14]1.[Cl:68][CH2:69][Cl:70].[Na+:66].[Na+:67].[OH:50][O:51][C:52]([c:53]1[cH:54][c:55]([Cl:56])[cH:57][cH:58][cH:59]1)=[O:60].[S:61]([O-:62])([O-:63])(=[O:64])=[S:65]>>[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:49]2)[CH:20]=[C:21]([C:29](=[O:30])[NH:31][c:32]2[cH:33][c:34]([CH3:48])[c:35]([S:38]([CH2:39][c:40]4[n:41][n:42][cH:43][n:44]4[CH2:45][CH2:46][CH3:47])=[O:50])[cH:36][cH:37]2)[CH2:22][CH2:23][N:24]3[CH2:25][CH:26]([CH3:27])[CH3:28])[cH:13][cH:14]1

Participants

6

Sources & evidence

ORD record
ord-c86771dbd6894ca397597acf082d4e7e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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