HCID 20595432, compound → HCID 18009049, compound
Reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH:8]([CH2:9][c:10]1[c:11](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:12][cH:13][cH:14][cH:15]1)[C:22]([NH:23][CH2:24][CH2:25][CH2:26][CH:27]([CH2:28][OH:29])[N:30]([CH2:31][CH:32]([CH3:33])[CH3:34])[S:35](=[O:36])(=[O:37])[c:38]1[cH:39][cH:40][c:41]([NH2:44])[cH:42][cH:43]1)=[O:45])([CH3:5])([CH3:6])[CH3:46].[C:47]([O:48][C:49](=[O:50])[NH:51][CH:52]([C:53](=[O:54])[NH:55][CH2:56][CH2:57][CH2:58][CH2:59][CH:60]([N:61]([S:62]([c:63]1[cH:64][cH:65][c:66]([NH2:67])[cH:68][cH:69]1)(=[O:70])=[O:71])[CH2:72][CH:73]([CH3:74])[CH3:75])[CH2:76][OH:77])[CH2:78][c:79]1[cH:80][cH:81][c:82]2[c:83]([cH:84][cH:85][cH:86][cH:87]2)[cH:88]1)([CH3:89])([CH3:90])[CH3:91]>>[NH2:7][CH:8]([CH2:9][c:10]1[c:11](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:12][cH:13][cH:14][cH:15]1)[C:22]([NH:23][CH2:24][CH2:25][CH2:26][CH:27]([CH2:28][OH:29])[N:30]([CH2:31][CH:32]([CH3:33])[CH3:34])[S:35](=[O:36])(=[O:37])[c:38]1[cH:39][cH:40][c:41]([NH2:44])[cH:42][cH:43]1)=[O:45]Participants
3
Sources & evidence
- ORD record
- ord-4035166b71b44362930f750a852af5f1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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