Hydrochloric Acid → 3-[[[1-[4-(3-Hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]-3-methylbutan-2-yl]amino]methyl]-1,2,3,4-tetrahydroisoquinolin-7-ol

HRID 94055Notes

Reaction equation

[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:35][OH:36].[ClH:37].[OH:1][c:2]1[cH:3][cH:4][c:5]2[c:10]([cH:11]1)[CH2:9][NH:8][CH:7]([C:12](=[O:13])[NH:14][CH:15]([CH:16]([CH3:17])[CH3:18])[CH2:19][N:20]1[CH2:21][CH:22]([CH3:34])[C:23]([CH3:26])([c:27]3[cH:28][c:29]([OH:33])[cH:30][cH:31][cH:32]3)[CH2:24][CH2:25]1)[CH2:6]2>>[OH:1][c:2]1[cH:3][cH:4][c:5]2[c:10]([cH:11]1)[CH2:9][NH:8][CH:7]([CH2:12][NH:14][CH:15]([CH:16]([CH3:17])[CH3:18])[CH2:19][N:20]1[CH2:21][CH:22]([CH3:34])[C:23]([CH3:26])([c:27]3[cH:28][c:29]([OH:33])[cH:30][cH:31][cH:32]3)[CH2:24][CH2:25]1)[CH2:6]2

Participants

Reactant 4

HCID 313Hydrochloric Acid

HCID 887Methanol

HCID 8028Tetrahydrofuran

HCID 222682807-hydroxy-N-(1-((4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl)methyl)-2-methylpropyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxamide

Product 1

HCID 222682773-[[[1-[4-(3-Hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]-3-methylbutan-2-yl]amino]methyl]-1,2,3,4-tetrahydroisoquinolin-7-ol

Sources & evidence

ORD record: ord-eb5015ca2b0747d489de505098704397
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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