Ammonium → HCID 67041003, compound

HRID 139437Notes

Reaction equation

HRID 139437 reaction equation
[CH3:47][CH2:48][OH:49].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[Cl-:45].[Fe:62].[NH4+:46].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[OH2:55].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:13]1[CH:12]([CH2:14][O:15][C:16]([NH:17][c:18]1[cH:19][cH:20][c:21]([S:24][c:25]3[c:26]([N+:41]([O-:42])=[O:43])[cH:27][c:28]([C:31]([NH:32][c:33]4[cH:34][n:35][cH:36][c:37]([F:39])[cH:38]4)=[O:40])[cH:29][cH:30]3)[cH:22][cH:23]1)=[O:44])[c:11]1[c:6]-2[cH:7][cH:8][cH:9][cH:10]1>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:13]1[CH:12]([CH2:14][O:15][C:16]([NH:17][c:18]1[cH:19][cH:20][c:21]([S:24][c:25]3[c:26]([NH2:41])[cH:27][c:28]([C:31]([NH:32][c:33]4[cH:34][n:35][cH:36][c:37]([F:39])[cH:38]4)=[O:40])[cH:29][cH:30]3)[cH:22][cH:23]1)=[O:44])[c:11]1[c:6]-2[cH:7][cH:8][cH:9][cH:10]1

Participants

9

Sources & evidence

ORD record
ord-816315b3e868463e968ac0469b81e1a4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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