Hydrochloric Acid → HCID 178437517, compound

HRID 298418Notes

Reaction equation

HRID 298418 reaction equation
[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][c:6]2[c:7]1[n:8][c:9]([CH2:59][CH3:60])[c:10]([CH2:19][NH:20][C:21]([C:22]([CH2:23][C:24](=[O:25])[NH:26][CH2:27][c:28]1[cH:29][cH:30][c:31]([F:55])[c:32](-[c:34]3[cH:35][c:36]([CH2:40][N:41]4[CH2:42][CH:43]([CH3:54])[N:44]([C:47]([O:48][C:49]([CH3:50])([CH3:51])[CH3:52])=[O:53])[CH2:45][CH2:46]4)[cH:37][cH:38][cH:39]3)[cH:33]1)([CH3:56])[CH3:57])=[O:58])[c:11]2[NH:12][CH:13]1[CH2:14][CH2:15][O:16][CH2:17][CH2:18]1.[CH3:68][OH:69].[ClH:61].[O:62]1[CH2:63][CH2:64][O:65][CH2:66][CH2:67]1>>[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][c:6]2[c:7]1[n:8][c:9]([CH2:59][CH3:60])[c:10]([CH2:19][NH:20][C:21]([C:22]([CH2:23][C:24](=[O:25])[NH:26][CH2:27][c:28]1[cH:29][cH:30][c:31]([F:55])[c:32](-[c:34]3[cH:35][c:36]([CH2:40][N:41]4[CH2:42][CH:43]([CH3:54])[NH:44][CH2:45][CH2:46]4)[cH:37][cH:38][cH:39]3)[cH:33]1)([CH3:56])[CH3:57])=[O:58])[c:11]2[NH:12][CH:13]1[CH2:14][CH2:15][O:16][CH2:17][CH2:18]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 887MethanolHCID 312751,4-DioxaneHCID 178437518HCID 178437518, compound

Product 1

HCID 178437517HCID 178437517, compound

Sources & evidence

ORD record
ord-37499d43a70b49328c19071b284562a8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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