HCID 178438137, compound → HCID 178458163, compound
Reaction equation
[CH3:1][C:2]1([CH3:3])[CH2:6][O:7][CH:5]([CH:8]([CH3:9])[CH:10]2[CH2:11][CH2:12][CH:13]3[CH:14]4[CH:15]([O:31][C:32]([N:33]([CH3:34])[CH3:35])=[O:36])[CH:16]=[C:17]5[CH2:18][CH:19]([OH:30])[CH:20]6[CH:21]([C:22]5([CH3:23])[CH:24]4[CH2:25][CH2:26][C:27]23[CH3:28])[O:29]6)[O:4][CH2:37]1.[CH3:38][C:39]1([CH3:40])[CH2:41][O:42][CH:43]([CH:44]([CH:45]2[C:46]3([CH3:47])[CH:48]([CH:49]4[CH:50]([CH2:51][CH2:52]3)[C:53]3([CH3:54])[C:55](=[CH:62][CH:63]4[OH:64])[CH2:56][CH:57]([OH:58])[CH:59]4[O:60][CH:61]34)[CH2:65][CH2:66]2)[CH3:67])[O:68][CH2:69]1>>[O:4]=[CH:5][CH:8]([CH3:9])[CH:10]1[CH2:11][CH2:12][CH:13]2[CH:14]3[CH:15]([O:31][C:32]([N:33]([CH3:34])[CH3:35])=[O:36])[CH:16]=[C:17]4[CH2:18][CH:19]([OH:30])[CH:20]5[CH:21]([C:22]4([CH3:23])[CH:24]3[CH2:25][CH2:26][C:27]12[CH3:28])[O:29]5Participants
3
Sources & evidence
- ORD record
- ord-29fe161489d64a5ab99bb650082ccf81
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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