Chloride → 6-Isocodeine

HRID 188538

Reaction equation

[C:22](=[O:23])([O-:24])[O-:25].[CH3:30][N+:31]([CH3:32])([CH3:33])[c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[CH:1]12[CH:2]=[CH:3][CH:4]([OH:5])[CH:6]3[O:7][c:8]4[c:9]([OH:10])[cH:11][cH:12][c:13]5[c:21]4[C:20]13[CH2:19][CH2:18][N:16]([CH3:17])[CH:15]2[CH2:14]5.[Cl-:29].[K+:26].[K+:27].[OH2:28]>>[CH:1]12[CH:2]=[CH:3][CH:4]([OH:5])[CH:6]3[O:7][c:8]4[c:9]([O:10][CH3:22])[cH:11][cH:12][c:13]5[c:21]4[C:20]13[CH2:19][CH2:18][N:16]([CH3:17])[CH:15]2[CH2:14]5

Participants

Reactant 7

HCID 312Chloride

HCID 813Potassium Cation2×

HCID 962Water

HCID 1140Toluene

HCID 4253Morphinan-3,6alpha-diol, 7,8-didehydro-4,5alpha-epoxy-17-methyl-

HCID 15914Phenyltrimethylammonium

HCID 19660Carbonate Ion

Product 1

HCID 28286-Isocodeine

Sources & evidence

ORD record: ord-e6cbd0c633d14cb891fb4d6124312446
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Linked notes

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