Hydrochloric Acid → HCID 70223399, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][CH2:5][C:6](=[O:7])[OH:8].[CH2:31]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[N:38]([CH2:39][CH2:40][c:41]1[c:42](-[c:51]2[cH:52][c:53]([CH3:58])[cH:54][c:55]([CH3:57])[cH:56]2)[nH:43][c:44]2[cH:45][cH:46][c:47]([NH2:50])[cH:48][c:49]12)[CH2:59][CH2:60][CH2:61][CH2:62][c:63]1[cH:64][cH:65][c:66]([N+:69](=[O:70])[O-:71])[cH:67][cH:68]1.[CH3:20][N:21]([CH3:22])[CH2:23][CH2:24][CH2:25][N:26]=[C:27]=[N:28][CH2:29][CH3:30].[ClH:19].[OH:9][n:10]1[c:11]2[cH:12][cH:13][cH:14][cH:15][c:16]2[n:17][n:18]1>>[C:1]([CH3:2])(=[O:3])[NH:4][CH2:5][C:6](=[O:8])[NH:50][c:47]1[cH:46][cH:45][c:44]2[nH:43][c:42](-[c:51]3[cH:52][c:53]([CH3:58])[cH:54][c:55]([CH3:57])[cH:56]3)[c:41]([CH2:40][CH2:39][N:38]([CH2:31][c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[CH2:59][CH2:60][CH2:61][CH2:62][c:63]3[cH:64][cH:65][c:66]([N+:69](=[O:70])[O-:71])[cH:67][cH:68]3)[c:49]2[cH:48]1Participants
6
Sources & evidence
- ORD record
- ord-6635aa604f2d4d59bc2b0bc63306fc32
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…