Water → HCID 44546733, compound

HRID 1127135Notes

Reaction equation

HRID 1127135 reaction equation
[CH2:37]([N:38]([CH:39]([CH3:40])[CH3:41])[CH:42]([CH3:43])[CH3:44])[CH3:45].[CH3:53][N:54]([CH3:55])[CH:56]=[O:57].[F:1][C:2]1([F:36])[C:3](=[O:35])[N:4]([CH3:34])[c:5]2[c:6]([n:18][c:19]([NH:22][c:23]3[c:24]([O:32][CH3:33])[cH:25][c:26]([C:27](=[O:28])[OH:29])[cH:30][cH:31]3)[n:20][cH:21]2)[N:7]([CH2:9][CH2:10][CH2:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[CH2:8]1.[O:46]1[CH2:47][CH2:48][CH:49]([NH2:52])[CH2:50][CH2:51]1.[OH2:58]>>[F:1][C:2]1([F:36])[C:3](=[O:35])[N:4]([CH3:34])[c:5]2[c:6]([n:18][c:19]([NH:22][c:23]3[c:24]([O:32][CH3:33])[cH:25][c:26]([C:27](=[O:28])[NH:52][CH:49]4[CH2:48][CH2:47][O:46][CH2:51][CH2:50]4)[cH:30][cH:31]3)[n:20][cH:21]2)[N:7]([CH2:9][CH2:10][CH2:11][c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[CH2:8]1

Participants

6

Sources & evidence

ORD record
ord-6176b3d992f943d4a6fac865e837dbfa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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