Citric Acid → 3-Ethyl-5,5-dimethyl-4,5,6,7-tetrahydro-benzo[c]thiophene-1-carboxylic acid
Reaction equation
[CH2:15]([CH3:16])[I:17].[CH2:34]1[O:35][CH2:36][CH2:37][CH2:38]1.[CH3:19][OH:20].[CH3:1][C:2]1([CH3:14])[CH2:3][c:4]2[c:5]([c:6]([C:9](=[O:10])[OH:11])[s:7][cH:8]2)[CH2:12][CH2:13]1.[CH3:39][CH2:40][CH2:41][CH2:42][CH3:43].[OH2:18].[OH:21][C:22]([CH2:23][C:24]([C:25](=[O:26])[OH:27])([CH2:28][C:29](=[O:30])[OH:31])[OH:32])=[O:33]>>[CH3:1][C:2]1([CH3:14])[CH2:3][c:4]2[c:5]([c:6]([C:9](=[O:10])[OH:11])[s:7][c:8]2[CH2:15][CH3:16])[CH2:12][CH2:13]1Participants
8
Sources & evidence
- ORD record
- ord-9bfea6da64774ef182ac97bf22e1a3e1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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