Ethanol → 6-Isocodeine

HRID 676217

Reaction equation

HRID 676217 reaction equation
[CH3:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][C:34]([OH:35])=[O:36].[CH3:37][CH2:38][OH:39].[CH3:40][CH2:41][OH:42].[CH3:65][CH2:66][O:67][C:68](=[O:69])[CH3:70].[CH:1]12[CH:2]=[CH:3][CH:4]([OH:5])[CH:6]3[O:7][c:8]4[c:9]([O:10][CH3:11])[cH:12][cH:13][c:14]5[c:22]4[C:21]13[CH2:20][CH2:19][N:17]([CH3:18])[CH:16]2[CH2:15]5.[CH:43]12[C:44]34[c:45]5[c:46]([cH:53][cH:54][c:55]([O:56][CH3:57])[c:58]5[O:59][CH:60]3[CH:61]([OH:62])[CH:63]=[CH:64]1)[CH2:47][CH:48]2[N:49]([CH3:52])[CH2:50][CH2:51]4>>[CH3:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][C:34](=[O:35])[O-:36].[CH:1]12[CH:2]=[CH:3][CH:4]([OH:5])[CH:6]3[O:7][c:8]4[c:9]([O:10][CH3:11])[cH:12][cH:13][c:14]5[c:22]4[C:21]13[CH2:20][CH2:19][N:17]([CH3:18])[CH:16]2[CH2:15]5

Participants

6

Reactant 4

HCID 702Ethanol2×HCID 28286-Isocodeine2×HCID 3893Lauric AcidHCID 8857Ethyl Acetate

Product 2

HCID 28286-IsocodeineHCID 4149208Dodecanoate

Sources & evidence

ORD record
ord-d35f9fd52adc4696850548eac8825f17
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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