N-[4-[6-(2,2-diphenylethylamino)-2-hydrazinylpurin-9-yl]-2,3-dihydroxycyclopentyl]propanamide → HCID 178469992, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8][n:9](-[c:11]2[n:12][c:13]([NH:32][CH:33]([c:34]3[cH:35][cH:36][c:37]([O:38][CH3:39])[cH:40][cH:41]3)[c:42]3[cH:43][cH:44][c:45]([O:46][CH3:47])[cH:48][cH:49]3)[c:14]3[n:15][cH:16][n:17]([CH:20]4[CH:21]([OH:31])[CH:22]([OH:30])[CH:23]([NH:25][C:26]([CH2:27][CH3:28])=[O:29])[CH2:24]4)[c:18]3[n:19]2)[cH:10]1.[c:50]1([CH:56]([CH2:57][NH:58][c:59]2[n:60][c:61]([NH:62][NH2:63])[n:64][c:65]3[c:66]2[n:67][cH:68][n:69]3[CH:70]2[CH2:71][CH:72]([NH:73][C:74](=[O:75])[CH2:76][CH3:77])[CH:78]([OH:79])[CH:80]2[OH:81])[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8][n:9](-[c:11]2[n:12][c:13]([NH:32][CH2:57][CH:56]([c:50]3[cH:51][cH:52][cH:53][cH:54][cH:55]3)[c:82]3[cH:83][cH:84][cH:85][cH:86][cH:87]3)[c:14]3[n:15][cH:16][n:17]([CH:20]4[CH:21]([OH:31])[CH:22]([OH:30])[CH:23]([NH:25][C:26]([CH2:27][CH3:28])=[O:29])[CH2:24]4)[c:18]3[n:19]2)[cH:10]1Participants
3
Sources & evidence
- ORD record
- ord-bf511fe68927438899a6afb394ed0b54
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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