Water → HCID 66627331, compound
Reaction equation
[C:83](=[O:84])([O-:85])[O-:86].[CH3:34][N:35]1[CH2:36][CH2:37][NH:38][CH2:39][CH2:40]1.[Cs+:87].[Cs+:88].[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[CH:8]2[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][CH:16]3[CH2:17][CH2:18][CH:19]([NH:22][C:23](=[O:24])[c:25]4[n:26][cH:27][c:28]([Br:31])[cH:29][cH:30]4)[CH2:20][CH2:21]3)[CH2:12][CH2:13]2)[cH:32][cH:33]1.[O:90]1[CH2:91][CH2:92][O:93][CH2:94][CH2:95]1.[OH2:89].[c:41]1([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[c:49]2[c:50]3[c:74]([cH:75][cH:76][cH:77]2)[C:71]([CH3:72])([CH3:73])[c:53]2[c:52]([c:57]([P:58]([c:59]4[cH:60][cH:61][cH:62][cH:63][cH:64]4)[c:65]4[cH:66][cH:67][cH:68][cH:69][cH:70]4)[cH:56][cH:55][cH:54]2)[O:51]3)[cH:78][cH:79][cH:80][cH:81][cH:82]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[CH:8]2[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][CH:16]3[CH2:17][CH2:18][CH:19]([NH:22][C:23](=[O:24])[c:25]4[n:26][cH:27][c:28]([N:38]5[CH2:37][CH2:36][N:35]([CH3:34])[CH2:40][CH2:39]5)[cH:29][cH:30]4)[CH2:20][CH2:21]3)[CH2:12][CH2:13]2)[cH:32][cH:33]1Participants
8
Sources & evidence
- ORD record
- ord-c78abf00b2cf4e14b566ff0639f37635
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…