4,4-Dimethylpentanal → 10-(3,3-dimethylbutyl)-20-ethyl-6-fluoro-20-hydroxy-17-oxa-3,13-diazapentacyclo[11.9.0.02,11.04,9.015,21]docosa-1(22),2,4(9),5,7,10,15(21)-heptaene-14,18-dione
Reaction equation
[CH2:1]([CH3:2])[C:3]1([OH:28])[CH2:4][C:5](=[O:27])[O:6][CH2:7][c:8]2[c:9](=[O:26])[n:10]3[c:23]([cH:24][c:25]21)-[c:13]1[c:12]([cH:21][c:20]2[c:15]([n:14]1)[cH:16][c:17]([F:22])[cH:18][cH:19]2)[CH2:11]3.[CH3:29][C:30]([CH2:31][CH2:32][CH:33]=[O:34])([CH3:35])[CH3:36]>>[CH2:1]([CH3:2])[C:3]1([OH:28])[CH2:4][C:5](=[O:27])[O:6][CH2:7][c:8]2[c:9](=[O:26])[n:10]3[c:23]([cH:24][c:25]21)-[c:13]1[c:12]([c:21]([CH2:32][CH2:31][C:30]([CH3:29])([CH3:35])[CH3:36])[c:20]2[c:15]([n:14]1)[cH:16][c:17]([F:22])[cH:18][cH:19]2)[CH2:11]3Participants
3
Sources & evidence
- ORD record
- ord-9997f0b605f44c1c88e39262cc6abc66
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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