Acetone → [5-(hexadecanoylamino)-3-hydroxy-4-phenylmethoxy-6-prop-1-enoxyoxan-2-yl]methyl hexadecanoate
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH:9]1[CH:10]([NH:39][C:40]([CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][CH3:55])=[O:56])[CH:11]([O:12][CH2:13][CH:14]=[CH2:15])[O:16][CH:17]([CH2:20][O:21][C:22]([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37])=[O:38])[CH:18]1[OH:19].[CH3:57][CH2:58][OH:59].[CH3:78][C:79](=[O:80])[CH3:81].[Cl:74][CH:75]([Cl:76])[Cl:77].[N:66]12[CH2:67][CH2:68][N:69]([CH2:70][CH2:71]1)[CH2:72][CH2:73]2.[OH2:82].[cH:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH:9]1[CH:10]([NH:39][C:40]([CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][CH3:55])=[O:56])[CH:11]([O:12][CH:13]=[CH:14][CH3:15])[O:16][CH:17]([CH2:20][O:21][C:22]([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37])=[O:38])[CH:18]1[OH:19]Participants
8
Sources & evidence
- ORD record
- ord-4b36c5667f3f43089fd54d6f7739b74a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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