Water → HCID 178440850, compound
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:11][CH2:12][CH2:13][n:14]2[c:15](-[c:20]3[cH:21][cH:22][c:23]([OH:26])[cH:24][cH:25]3)[cH:16][cH:17][c:18]2[CH3:19])[cH:9][cH:10]1.[CH3:72][c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1.[O:60]=[C:61]([O:62][CH2:63][CH3:64])[N:65]=[N:66][C:67]([O:68][CH2:69][CH3:70])=[O:71].[OH2:79].[OH:27][CH:28]([C:29](=[O:30])[O:31][CH2:32][CH3:33])[CH2:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[c:41]1([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[cH:55][cH:56][cH:57][cH:58][cH:59]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:11][CH2:12][CH2:13][n:14]2[c:15](-[c:20]3[cH:21][cH:22][c:23]([O:26][CH:28]([C:29](=[O:30])[O:31][CH2:32][CH3:33])[CH2:34][c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)[cH:24][cH:25]3)[cH:16][cH:17][c:18]2[CH3:19])[cH:9][cH:10]1Participants
7
Sources & evidence
- ORD record
- ord-4ec0b144349d4747b0636c9a5620c54b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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