HCID 11315175, compound → HCID 86600880, compound
Reaction equation
[CH2:1]([CH3:2])[c:3]1[c:4]([C:5](=[O:6])[OH:7])[cH:8][c:9]([NH:14][C:15](=[O:16])[N:17]2[CH2:18][CH2:19][N:20]([c:23]3[cH:24][c:25]([O:33][CH3:34])[c:26]([O:31][CH3:32])[c:27]([O:29][CH3:30])[cH:28]3)[CH2:21][CH2:22]2)[c:10]([O:12][CH3:13])[n:11]1.[cH:35]1[cH:36][cH:37][cH:38][c:39]2[n:40][c:41]3[cH:42][cH:43][cH:44][cH:45][c:46]3[c:47]([NH:49][c:50]3[cH:51][c:52]([NH:58][C:59]([CH:60]([CH3:61])[NH2:62])=[O:63])[cH:53][c:54]([CH2:56][OH:57])[cH:55]3)[c:48]12>>[CH2:1]([CH3:2])[c:3]1[c:4]([C:5](=[O:6])[NH:62][CH:60]([C:59]([NH:58][c:52]2[cH:51][c:50]([NH:49][c:47]3[c:46]4[c:41]([n:40][c:39]5[cH:38][cH:37][cH:36][cH:35][c:48]53)[cH:42][cH:43][cH:44][cH:45]4)[cH:55][c:54]([CH2:56][OH:57])[cH:53]2)=[O:63])[CH3:61])[cH:8][c:9]([NH:14][C:15](=[O:16])[N:17]2[CH2:18][CH2:19][N:20]([c:23]3[cH:24][c:25]([O:33][CH3:34])[c:26]([O:31][CH3:32])[c:27]([O:29][CH3:30])[cH:28]3)[CH2:21][CH2:22]2)[c:10]([O:12][CH3:13])[n:11]1Participants
3
Sources & evidence
- ORD record
- ord-2db5434a22334baabfcf8441ca656d2f
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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