Citric Acid → 7-(N-(4-(1-hydroxyhexyl)phenyl)acetamido)hept-5-ynoic acid
Reaction equation
[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[Li+:1].[OH-:2].[OH2:43].[OH:30][C:31]([CH2:32][C:33]([C:34](=[O:35])[OH:36])([CH2:37][C:38](=[O:39])[OH:40])[OH:41])=[O:42].[OH:3][CH:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH3:9])[c:10]1[cH:11][cH:12][c:13]([N:16]([C:17]([CH3:18])=[O:19])[CH2:20][C:21]#[C:22][CH2:23][CH2:24][CH2:25][C:26](=[O:27])[O:28][CH3:29])[cH:14][cH:15]1>>[OH:3][CH:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH3:9])[c:10]1[cH:11][cH:12][c:13]([N:16]([C:17]([CH3:18])=[O:19])[CH2:20][C:21]#[C:22][CH2:23][CH2:24][CH2:25][C:26](=[O:27])[OH:28])[cH:14][cH:15]1Participants
7
Sources & evidence
- ORD record
- ord-6902a014d4ef44b184ece98ff38fcd2a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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