Citric Acid → HCID 178473196, compound
Reaction equation
[C:71]([CH3:72])([CH3:73])([CH3:74])[O:75][C:76]([CH2:77][NH2:78])=[O:79].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH:7]([CH2:45][CH3:46])[CH2:8][CH:9]([NH:20][c:21]2[n:22][cH:23][c:24]([C:42](=[O:43])[OH:44])[c:25]([CH2:27][c:28]3[cH:29][c:30]([C:38]([F:39])([F:40])[F:41])[cH:31][c:32]([C:34]([F:35])([F:36])[F:37])[cH:33]3)[n:26]2)[c:10]2[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][cH:14][c:15]21.[CH2:59]([N:60]=[C:61]=[N:62][CH2:63][CH2:64][CH2:65][N:66]([CH3:67])[CH3:68])[CH3:69].[CH3:104][CH2:105][N:106]([CH2:107][CH3:108])[CH2:109][CH3:110].[CH3:93][N:94]([CH3:95])[CH:96]=[O:97].[CH3:98][CH2:99][O:100][C:101](=[O:102])[CH3:103].[ClH:58].[ClH:70].[OH2:47].[OH:48][n:49]1[c:50]2[cH:51][cH:52][cH:53][cH:54][c:55]2[n:56][n:57]1.[OH:80][C:81]([CH2:82][C:83]([C:84](=[O:85])[OH:86])([CH2:87][C:88](=[O:89])[OH:90])[OH:91])=[O:92]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH:7]([CH2:45][CH3:46])[CH2:8][CH:9]([NH:20][c:21]2[n:22][cH:23][c:24]([C:42](=[O:43])[NH:78][CH2:77][C:76]([O:75][C:71]([CH3:72])([CH3:73])[CH3:74])=[O:79])[c:25]([CH2:27][c:28]3[cH:29][c:30]([C:38]([F:39])([F:40])[F:41])[cH:31][c:32]([C:34]([F:35])([F:36])[F:37])[cH:33]3)[n:26]2)[c:10]2[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][cH:14][c:15]21Participants
11
Reactant 10
Product 1
Sources & evidence
- ORD record
- ord-efde434105224967ac2fb1ea9f49d4d1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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