4-Amino-1-pentofuranosyl-2(1H)-pyrimidinone → HCID 178442606, compound
Reaction equation
[C:43]([Cl:44])(=[O:45])[O:46][CH2:47][CH3:48].[CH3:1][CH:2]([CH3:3])[CH2:4][CH2:5][CH2:6][CH:7]([CH3:8])[CH:9]1[CH2:10][CH2:11][CH:12]2[CH:13]3[CH2:14][CH:15]=[C:16]4[CH2:17][CH:18]([O:28][C:29](=[O:30])[NH:31][CH2:32][C:33](=[O:34])[OH:35])[CH2:19][CH2:20][C:21]4([CH3:22])[CH:23]3[CH2:24][CH2:25][C:26]12[CH3:27].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:71][N:72]([CH3:73])[CH:74]=[O:75].[CH:49]1([n:58]2[c:59](=[O:60])[n:61][c:62]([NH2:63])[cH:64][cH:65]2)[CH:50]([OH:51])[CH:52]([OH:53])[CH:54]([CH2:56][OH:57])[O:55]1.[O:66]1[CH2:67][CH2:68][CH2:69][CH2:70]1>>[CH3:1][CH:2]([CH3:3])[CH2:4][CH2:5][CH2:6][CH:7]([CH3:8])[CH:9]1[CH2:10][CH2:11][CH:12]2[CH:13]3[CH2:14][CH:15]=[C:16]4[CH2:17][CH:18]([O:28][C:29](=[O:30])[NH:31][CH2:32][C:33](=[O:34])[NH:63][c:62]5[n:61][c:59](=[O:60])[n:58]([CH:49]6[CH:50]([OH:51])[CH:52]([OH:53])[CH:54]([CH2:56][OH:57])[O:55]6)[cH:65][cH:64]5)[CH2:19][CH2:20][C:21]4([CH3:22])[CH:23]3[CH2:24][CH2:25][C:26]12[CH3:27]Participants
7
Sources & evidence
- ORD record
- ord-46eec2569a5841edb5ca11babc19c9c0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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