HCID 21978267, compound → HCID 178464988, compound

Reaction equation

[CH:43]([CH3:44])([CH3:45])[CH:46]1[CH2:47][CH2:48][N:49]([CH2:52][CH2:53][NH:54][C:55](=[O:56])[n:57]2[cH:58][cH:59][n:60][cH:61]2)[CH2:50][CH2:51]1.[NH2:1][CH2:2][CH2:3][NH:4][C:5](=[O:6])[c:7]1[n:8][c:9]([NH:28][CH2:29][CH:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:10]2[n:11][cH:12][n:13]([CH:16]3[O:17][CH:18]([C:23](=[O:24])[NH:25][CH2:26][CH3:27])[CH:19]([OH:22])[CH:20]3[OH:21])[c:14]2[n:15]1>>[NH:1]([CH2:2][CH2:3][NH:4][C:5](=[O:6])[c:7]1[n:8][c:9]([NH:28][CH2:29][CH:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:10]2[n:11][cH:12][n:13]([CH:16]3[O:17][CH:18]([C:23](=[O:24])[NH:25][CH2:26][CH3:27])[CH:19]([OH:22])[CH:20]3[OH:21])[c:14]2[n:15]1)[C:55]([NH:54][CH2:53][CH2:52][N:49]1[CH2:48][CH2:47][CH:46]([CH:43]([CH3:44])[CH3:45])[CH2:51][CH2:50]1)=[O:56]

Participants

Reactant 2

HCID 21978267HCID 21978267, compound

HCID 178464989N-(2-aminoethyl)-6-(2,2-diphenylethylamino)-9-[5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purine-2-carboxamide

Product 1

HCID 178464988HCID 178464988, compound

Sources & evidence

ORD record: ord-167aafecf27e43088a11fe611ae548a2
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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