2,5-Furandimethanol → 1-(3,4,5-Trimethoxy-benzoyl)-3-[2-[4-[1-(5-hydroxymethylfur-2-ylmethyl)-1H-benzoimidazole-2-carbonyl]-piperidin-1-yl]-ethyl]-3-phenyl-pyrrolidine

HRID 86873

Reaction equation

HRID 86873 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][C:10]([c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)([CH2:19][CH2:20][N:21]3[CH2:22][CH2:23][CH:24]([C:27](=[O:28])[c:29]4[n:30][c:31]5[c:32]([nH:33]4)[cH:34][cH:35][cH:36][cH:37]5)[CH2:25][CH2:26]3)[CH2:11][CH2:12]2)[cH:38][c:39]([O:43][CH3:44])[c:40]1[O:41][CH3:42].[OH:45][CH2:46][c:47]1[o:48][c:49]([CH2:52][OH:53])[cH:50][cH:51]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][C:10]([c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)([CH2:19][CH2:20][N:21]3[CH2:22][CH2:23][CH:24]([C:27](=[O:28])[c:29]4[n:30]([CH2:52][c:49]5[o:48][c:47]([CH2:46][OH:45])[cH:51][cH:50]5)[c:31]5[c:32]([n:33]4)[cH:34][cH:35][cH:36][cH:37]5)[CH2:25][CH2:26]3)[CH2:11][CH2:12]2)[cH:38][c:39]([O:43][CH3:44])[c:40]1[O:41][CH3:42]

Participants

3

Reactant 2

HCID 746632,5-FurandimethanolHCID 101213901-(3,4,5-trimethoxy-benzoyl)-3-[2-[4-[1H-benzoimidazole-2-carbonyl]-piperidin-1-yl]-ethyl]-3-phenyl-pyrrolidine

Product 1

HCID 155428771-(3,4,5-Trimethoxy-benzoyl)-3-[2-[4-[1-(5-hydroxymethylfur-2-ylmethyl)-1H-benzoimidazole-2-carbonyl]-piperidin-1-yl]-ethyl]-3-phenyl-pyrrolidine

Sources & evidence

ORD record
ord-b3c2960d5cc942fbb615cbe773b53cda
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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