Hydrochloric Acid → HCID 70236790, compound

HRID 681426Notes

Reaction equation

HRID 681426 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[cH:10][n:11][c:12](-[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[n:13]([CH:16]([CH2:17][CH2:18][C:19](=[O:20])[NH:21][CH2:22][C:23]2=[C:28]([n:29]3[c:30](=[O:35])[cH:31][cH:32][cH:33][cH:34]3)[CH:27]=[CH:26][C:25](=[O:36])[CH:24]2[OH:37])[CH2:38][CH2:39][CH2:40][CH3:41])[c:14]1=[O:15].[CH3:49][N:50]([CH3:51])[CH2:52][CH2:53][CH2:54][N:55]=[C:56]=[N:57][CH2:58][CH3:59].[CH3:73][S:74]([CH3:75])=[O:76].[CH3:77][CH2:78][O:79][C:80](=[O:81])[CH3:82].[ClH:48].[F:60][C:61]([F:62])([F:63])[C:64]([O-:65])=[O:66].[nH+:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[cH:10][n:11][c:12](-[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[n:13]([CH:16]([CH2:17][CH2:18][C:19](=[O:20])[NH:21][CH2:22][C:23]2=[C:28]([n:29]3[c:30](=[O:35])[cH:31][cH:32][cH:33][cH:34]3)[CH:27]=[CH:26][C:25](=[O:36])[C:24]2=[O:37])[CH2:38][CH2:39][CH2:40][CH3:41])[c:14]1=[O:15]

Participants

8

Sources & evidence

ORD record
ord-48c6bdf83f154dfebac551edd13692f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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