Hydrochloric Acid → HCID 72298212, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH3:10])[C:11](=[O:12])[OH:13].[CH3:15][N:16]([CH3:17])[CH2:18][CH2:19][CH2:20][N:21]=[C:22]=[N:23][CH2:24][CH3:25].[CH:37]([N:38]([CH2:39][CH3:40])[CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45].[ClH:14].[F:90][C:91]([F:92])([F:93])[C:94]([OH:95])=[O:96].[NH2:46][CH:47]([CH3:48])[C:49](=[O:50])[O:51][CH2:52][CH2:53][O:54][c:55]1[cH:56][cH:57][c:58](-[c:61]2[c:62]([C:88]#[N:89])[c:63]([S:74][CH2:75][c:76]3[n:77][c:78](-[c:81]4[cH:82][cH:83][c:84]([Cl:87])[cH:85][cH:86]4)[s:79][cH:80]3)[n:64][c:65]([N:69]3[CH2:70][CH2:71][CH2:72][CH2:73]3)[c:66]2[C:67]#[N:68])[cH:59][cH:60]1.[O:97]=[CH:98][N:99]([CH3:100])[CH3:101].[OH2:102].[OH2:26].[OH:27][n:28]1[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]2[n:35][n:36]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH3:10])[C:11](=[O:13])[NH:46][CH:47]([CH3:48])[C:49](=[O:50])[O:51][CH2:52][CH2:53][O:54][c:55]1[cH:56][cH:57][c:58](-[c:61]2[c:62]([C:88]#[N:89])[c:63]([S:74][CH2:75][c:76]3[n:77][c:78](-[c:81]4[cH:82][cH:83][c:84]([Cl:87])[cH:85][cH:86]4)[s:79][cH:80]3)[n:64][c:65]([N:69]3[CH2:70][CH2:71][CH2:72][CH2:73]3)[c:66]2[C:67]#[N:68])[cH:59][cH:60]1Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-0366a6c902a24f73a59fdd701c8fb614
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…