HCID 178438132, compound → HCID 178500090, compound
Reaction equation
[CH3:29][C:30]1([CH3:31])[CH2:32][O:33][CH:34]([CH:35]([CH:36]2[C:37]3([CH3:38])[CH:39]([C:40]4=[CH:54][CH:53]=[C:46]5[C:44]([CH3:45])([CH:41]4[CH2:42][CH2:43]3)[CH:52]3[CH:50]([CH:48]([OH:49])[CH2:47]5)[O:51]3)[CH2:55][CH2:56]2)[CH3:57])[O:58][CH2:59]1.[O:1]1[CH:2]2[CH:3]1[CH:4]([OH:28])[CH2:5][C:6]1=[CH:7][CH:8]=[C:9]3[CH:10]4[CH2:11][CH2:12][CH:13]([CH:14]([CH:15]([O:16][CH3:17])[O:18][CH3:19])[CH3:20])[C:21]4([CH3:27])[CH2:22][CH2:23][CH:24]3[C:25]21[CH3:26]>>[OH:1][CH:2]1[CH2:3][CH:4]([OH:28])[CH2:5][C:6]2=[CH:7][CH:8]=[C:9]3[CH:10]4[CH2:11][CH2:12][CH:13]([CH:14]([CH:15]([O:16][CH3:17])[O:18][CH3:19])[CH3:20])[C:21]4([CH3:27])[CH2:22][CH2:23][CH:24]3[C:25]12[CH3:26]Participants
3
Sources & evidence
- ORD record
- ord-8b8537a91d28468da41d46eaabb36708
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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