Water → HCID 178498223, compound

HRID 1227110Notes

Reaction equation

HRID 1227110 reaction equation
[CH2:59]1[O:60][CH2:61][CH2:62][CH2:63]1.[CH3:1][O:2][C:3](=[O:4])[CH:5]1[C:6]([CH3:38])([CH3:39])[CH2:7][C:8]([OH:11])([c:12]2[s:13][c:14](-[c:17]3[cH:18][c:19]([CH2:34][N:35]=[N+:36]=[N-:37])[cH:20][c:21]([NH:23][c:24]4[n:25][cH:26][cH:27][c:28]([C:30]([F:31])([F:32])[F:33])[n:29]4)[cH:22]3)[cH:15][n:16]2)[CH2:9][CH2:10]1.[OH2:64].[c:40]1([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[cH:54][cH:55][cH:56][cH:57][cH:58]1>>[CH3:1][O:2][C:3](=[O:4])[CH:5]1[C:6]([CH3:38])([CH3:39])[CH2:7][C:8]([OH:11])([c:12]2[s:13][c:14](-[c:17]3[cH:18][c:19]([CH2:34][NH2:35])[cH:20][c:21]([NH:23][c:24]4[n:25][cH:26][cH:27][c:28]([C:30]([F:31])([F:32])[F:33])[n:29]4)[cH:22]3)[cH:15][n:16]2)[CH2:9][CH2:10]1

Participants

5

Sources & evidence

ORD record
ord-d779d34e9c28422a830012bbdfa06851
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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