Methanol → HCID 178418674, compound

HRID 2343394

Reaction equation

HRID 2343394 reaction equation
[CH3:28][OH:29].[CH:43]([Cl:44])([Cl:45])[Cl:46].[H:40][H:41].[O:1]1[CH:2]([O:7][CH2:8][C:9]#[C:10][n:11]2[cH:12][n:13][c:14]3[n:20][c:19]([NH:21][C:22]([C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[cH:18][c:15]-3[c:16]2[OH:17])[CH2:3][CH2:4][CH2:5][CH2:6]1.[Pd:42].[cH:30]1[cH:31][c:32]2[c:33]([n:34][cH:35][cH:36][cH:37]2)[cH:38][cH:39]1>>[O:1]1[CH:2]([O:7][CH2:8][CH:9]=[CH:10][n:11]2[cH:12][n:13][c:14]3[n:20][c:19]([NH:21][C:22]([C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[cH:18][c:15]-3[c:16]2[OH:17])[CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

7

Sources & evidence

ORD record
ord-f77e2081f82e4eb7b9914847bb977772
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Linked notes

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