Hydrochloric Acid → HCID 178449344, compound
Reaction equation
[C:57]([O:58][C:59]([NH:60][CH:61]([C:62]([NH:63][CH:64]([CH2:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1)[CH:72]([OH:73])[C:74]([N:75]1[CH2:76][CH2:77][CH2:78][CH:79]1[C:80]([NH:81][C:82]([CH3:83])([CH3:84])[CH3:85])=[O:86])=[O:87])=[O:88])[CH2:89][C:90](=[O:91])[NH2:92])=[O:93])([CH3:94])([CH3:95])[CH3:96].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][c:12]1[cH:13][cH:14][c:15]([O:16][CH2:17][C:18](=[O:19])[OH:20])[cH:21][cH:22]1.[ClH:23].[ClH:97].[NH2:24][CH:25]([CH2:26][C:27]([NH2:28])=[O:29])[C:30](=[O:31])[NH:32][CH:33]([CH:34]([C:35](=[O:36])[N:37]1[CH:38]([C:39](=[O:40])[NH:41][C:42]([CH3:43])([CH3:44])[CH3:45])[CH2:46][CH2:47][CH2:48]1)[OH:49])[CH2:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[O:98]1[CH2:99][CH2:100][O:101][CH2:102][CH2:103]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][c:12]1[cH:13][cH:14][c:15]([O:16][CH2:17][C:18](=[O:20])[NH:24][CH:25]([CH2:26][C:27]([NH2:28])=[O:29])[C:30](=[O:31])[NH:32][CH:33]([CH:34]([C:35](=[O:36])[N:37]2[CH:38]([C:39](=[O:40])[NH:41][C:42]([CH3:43])([CH3:44])[CH3:45])[CH2:46][CH2:47][CH2:48]2)[OH:49])[CH2:50][c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[cH:21][cH:22]1Participants
6
Sources & evidence
- ORD record
- ord-d60845588fa5410f9eb159a3066bfb91
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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