Hydrochloric Acid → HCID 72297397, compound

HRID 212330Notes

Reaction equation

HRID 212330 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH2:7][CH2:8][CH:9]([N:12]2[c:13]3[c:14]([cH:41][c:42]([CH3:49])[c:43]([C:45]([F:46])([F:47])[F:48])[cH:44]3)[CH:15]([N:19]([c:20]3[n:21][n:22][n:23]([CH3:25])[n:24]3)[CH2:26][c:27]3[cH:28][c:29]([C:37]([F:38])([F:39])[F:40])[cH:30][c:31]([C:33]([F:34])([F:35])[F:36])[cH:32]3)[CH2:16][CH2:17][CH2:18]2)[CH2:10][CH2:11]1.[CH3:53][OH:54].[ClH:52].[Na+:51].[OH-:50].[OH2:55]>>[O:3]=[C:4]([OH:5])[CH:6]1[CH2:7][CH2:8][CH:9]([N:12]2[c:13]3[c:14]([cH:41][c:42]([CH3:49])[c:43]([C:45]([F:46])([F:47])[F:48])[cH:44]3)[CH:15]([N:19]([c:20]3[n:21][n:22][n:23]([CH3:25])[n:24]3)[CH2:26][c:27]3[cH:28][c:29]([C:37]([F:38])([F:39])[F:40])[cH:30][c:31]([C:33]([F:34])([F:35])[F:36])[cH:32]3)[CH2:16][CH2:17][CH2:18]2)[CH2:10][CH2:11]1

Participants

7

Sources & evidence

ORD record
ord-29ede7c10f2f441ab94e3a0498d238e3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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