3-(2,5-Dimethoxyphenyl)-2-propenoic acid → N-[2-(3,4-dihydroxyphenyl)ethyl]-2-[3-(2,5-dimethoxyphenyl)prop-2-enoylamino]-3-[(2-methylpropan-2-yl)oxy]propanamide

HRID 1232657Notes

Reaction equation

HRID 1232657 reaction equation
[CH3:39][O:40][c:41]1[c:42]([CH:43]=[CH:44][C:45]([OH:46])=[O:47])[cH:48][c:49]([O:52][CH3:53])[cH:50][cH:51]1.[cH:1]1[c:2]2[c:12]([cH:13][cH:14][cH:15]1)-[c:7]1[c:6]([cH:11][cH:10][cH:9][cH:8]1)[CH:3]2[CH2:4][O:5][C:16](=[O:17])[NH:18][CH:19]([CH2:20][O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[C:26](=[O:27])[NH:28][CH2:29][CH2:30][c:31]1[cH:32][c:33]([OH:34])[c:35]([OH:36])[cH:37][cH:38]1>>[C:16](=[O:17])([NH:18][CH:19]([CH2:20][O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[C:26](=[O:27])[NH:28][CH2:29][CH2:30][c:31]1[cH:32][c:33]([OH:34])[c:35]([OH:36])[cH:37][cH:38]1)[CH:44]=[CH:43][c:42]1[c:41]([O:40][CH3:39])[cH:51][cH:50][c:49]([O:52][CH3:53])[cH:48]1

Participants

3

Sources & evidence

ORD record
ord-8a3223ac4f9b4bfca6da7a1d9b794853
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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