Hydrochloric Acid → HCID 178495237, compound
Reaction equation
[CH2:84]1[CH2:85][CH2:86][C:87]2=[N:92][CH2:91][CH2:90][CH2:89][N:88]2[CH2:93][CH2:94]1.[CH3:59][CH2:60][O:61][C:62]([CH3:63])=[O:64].[CH:75]([N:76]([CH:77]([CH3:78])[CH3:79])[CH2:80][CH3:81])([CH3:82])[CH3:83].[ClH:58].[c:65]1([CH2:66][C:67]([Cl:68])=[O:69])[cH:70][cH:71][cH:72][cH:73][cH:74]1.[cH:1]1[c:2]2[c:14]([cH:15][cH:16][cH:17]1)-[c:9]1[c:8]([cH:13][cH:12][cH:11][cH:10]1)[CH:3]2[CH2:4][O:5][C:6](=[O:7])[N:18]1[CH2:19][CH:20]([C:34]([N:35]([c:36]2[cH:37][cH:38][c:39]3[c:40]([cH:53]2)[N:41]([CH2:48][CH2:49][CH2:50][O:51][CH3:52])[C:42](=[O:47])[C:43]([CH3:45])([CH3:46])[O:44]3)[CH:54]2[CH2:55][CH2:56]2)=[O:57])[CH2:21][CH:22]([NH:24][C:25]([CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)=[O:33])[CH2:23]1>>[NH:18]1[CH2:19][CH:20]([C:34]([N:35]([c:36]2[cH:37][cH:38][c:39]3[c:40]([cH:53]2)[N:41]([CH2:48][CH2:49][CH2:50][O:51][CH3:52])[C:42](=[O:47])[C:43]([CH3:45])([CH3:46])[O:44]3)[CH:54]2[CH2:55][CH2:56]2)=[O:57])[CH2:21][CH:22]([NH:24][C:25]([CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)=[O:33])[CH2:23]1Participants
7
Sources & evidence
- ORD record
- ord-267de6e42b964e63b14dcbdee3222995
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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