Ethanol → (+)-7-Hydroxy-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-(2-methylprop-2-enyl)-1,2,3,4-tetrahydroisoquinoline

HRID 2146031Notes

Reaction equation

HRID 2146031 reaction equation
[C:24](=[O:25])([OH:26])[O-:27].[CH3:34][CH2:35][OH:36].[Cl:29][CH2:30][C:31](=[CH2:32])[CH3:33].[Na+:28].[OH:1][c:2]1[c:3]([O:22][CH3:23])[cH:4][c:5]2[c:10]([cH:11]1)[CH:9]([CH2:12][c:13]1[cH:14][c:15]([OH:21])[c:16]([O:19][CH3:20])[cH:17][cH:18]1)[NH:8][CH2:7][CH2:6]2>>[OH:1][c:2]1[c:3]([O:22][CH3:23])[cH:4][c:5]2[c:10]([cH:11]1)[CH:9]([CH2:12][c:13]1[cH:14][c:15]([OH:21])[c:16]([O:19][CH3:20])[cH:17][cH:18]1)[N:8]([CH2:32][C:31](=[CH2:30])[CH3:33])[CH2:7][CH2:6]2

Participants

6

Reactant 5

HCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium ionHCID 112413-Chloro-2-methyl-1-propeneHCID 44376613168-51-9

Product 1

HCID 20452308(+)-7-Hydroxy-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-(2-methylprop-2-enyl)-1,2,3,4-tetrahydroisoquinoline

Sources & evidence

ORD record
ord-96bec3a5d099475f9f9750f2330f9bd3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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