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Dataset #286

[CH3:51][S:52](/[CH:55]=[CH:4]/[C@@H:5]([NH:22][C:23]([C:24]1[CH:29]=[CH:28][CH:27]=[CH:26][CH:25]=1)([C:36]1[CH:41]=[CH:40][CH:39]=[CH:38][CH:37]=1)[C:30]1[CH:31]=[CH:32][CH:33]=[CH:34][CH:35]=1)[CH2:6][C:7]1[CH:21]=[CH:20][C:10]([CH2:11][NH:12][C:13](=[O:19])[O:14][C:15]([CH3:16])([CH3:18])[CH3:17])=[CH:9][CH:8]=1)(=[O:53])=[O:54]
Reaction #1340594
Yield 85.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][S:2](/[CH:5]=[CH:6]/[C@@H:7]([NH2:24])[CH2:8][C:9]1[CH:23]=[CH:22][C:12]([CH2:13][NH:14][C:15](=[O:21])[O:16][C:17]([CH3:19])([CH3:20])[CH3:18])=[CH:11][CH:10]=1)(=[O:3])=[O:4]
Reaction #1340595
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:32][S:34](/[CH:28]=[CH:26]/[C@@H:9]([NH2:8])[CH2:10][C:11]1[CH:25]=[CH:24][C:14]([CH2:15][NH:16][C:17](=[O:23])[O:18][C:19]([CH3:22])([CH3:21])[CH3:20])=[CH:13][CH:12]=1)(=[O:36])=[O:35]
Reaction #1340596
DOI: 10.6084/m9.figshare.5104873.v1
[OH:11][C:5]1[CH:4]=[CH:3][C:2]([NH:1][CH2:23][CH2:22][CH2:21][C:18]2[CH:19]=[CH:20][C:15]([N+:12]([O-:14])=[O:13])=[CH:16][CH:17]=2)=[CH:10][C:6]=1[C:7]([OH:9])=[O:8]
Reaction #1340597
Yield 50.4%DOI: 10.6084/m9.figshare.5104873.v1
[Br:14][C:4]#[C:3][C:2]([OH:1])([CH2:7][CH3:8])[CH2:5][CH3:6]
Reaction #1340598
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:1]([O:8][C:9]([N:11]1[CH2:15][C@H:14]([CH2:16][O:17][S:32]([C:29]2[CH:30]=[CH:31][C:26]([CH3:36])=[CH:27][CH:28]=2)(=[O:34])=[O:33])[C@H:13]([NH:18][C:19]([O:21][C:22]([CH3:25])([CH3:24])[CH3:23])=[O:20])[CH2:12]1)=[O:10])[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1
Reaction #1340599
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:3]([O:10][C:11]([N:13]1[CH2:17][C@H:16]([CH2:41][CH3:42])[C@H:15]([NH:30][C:31]([O:33][C:34]([CH3:35])([CH3:37])[CH3:36])=[O:32])[CH2:14]1)=[O:12])[C:4]1[CH:5]=[CH:6][CH:7]=[CH:8][CH:9]=1
Reaction #1340600
DOI: 10.6084/m9.figshare.5104873.v1
[C:22]([O:21][C:19]([NH:18][C@H:13]1[C@@H:14]([CH2:16][CH3:17])[CH2:15][NH:11][CH2:12]1)=[O:20])([CH3:25])([CH3:24])[CH3:23]
Reaction #1340601
DOI: 10.6084/m9.figshare.5104873.v1
[C:23]([O:22][C:20]([NH:19][C@H:13]1[C@@H:14]([CH2:16][CH2:17][CH3:18])[CH2:15][NH:11][CH2:12]1)=[O:21])([CH3:26])([CH3:25])[CH3:24]
Reaction #1340602
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:1]([O:8][C:9]([N:11]1[CH2:15][C@H:14]([CH:16]=[O:17])[C@H:13]([NH:18][C:19]([O:21][C:22]([CH3:25])([CH3:24])[CH3:23])=[O:20])[CH2:12]1)=[O:10])[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1
Reaction #1340603
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:4]([O:11][C:12]([N:14]1[CH2:18][C@H:17]([CH:19]=[CH2:30])[C@H:16]([NH:21][C:22]([O:24][C:25]([CH3:28])([CH3:27])[CH3:26])=[O:23])[CH2:15]1)=[O:13])[C:5]1[CH:10]=[CH:9][CH:8]=[CH:7][CH:6]=1
Reaction #1340604
DOI: 10.6084/m9.figshare.5104873.v1
[C:22]([O:21][C:19]([NH:18][C@H:13]1[C@@H:14]([CH:16]=[CH2:17])[CH2:15][NH:11][CH2:12]1)=[O:20])([CH3:25])([CH3:24])[CH3:23]
Reaction #1340605
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:4]([O:11][C:12]([N:14]1[CH2:18][C@H:17]([CH:19]2[CH2:3][CH2:20]2)[C@H:16]([NH:21][C:22]([O:24][C:25]([CH3:28])([CH3:27])[CH3:26])=[O:23])[CH2:15]1)=[O:13])[C:5]1[CH:6]=[CH:7][CH:8]=[CH:9][CH:10]=1
Reaction #1340606
DOI: 10.6084/m9.figshare.5104873.v1
[C:23]([O:22][C:20]([NH:19][C@H:13]1[C@@H:14]([CH:16]2[CH2:17][CH2:18]2)[CH2:15][NH:11][CH2:12]1)=[O:21])([CH3:26])([CH3:24])[CH3:25]
Reaction #1340607
DOI: 10.6084/m9.figshare.5104873.v1
[C:23]([O:22][C:20]([NH:19][C@H:13]1[CH:14]([CH:16]([CH3:18])[CH3:17])[CH2:15][NH:11][CH2:12]1)=[O:21])([CH3:26])([CH3:25])[CH3:24]
Reaction #1340608
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:11]([O:18][C:19]([N:21]1[CH2:25][CH:24]([CH:26]=[O:27])[C@H:23]([NH:28][C:29]([O:31][C:32]([CH3:35])([CH3:34])[CH3:33])=[O:30])[CH2:22]1)=[O:20])[C:12]1[CH:13]=[CH:14][CH:15]=[CH:16][CH:17]=1
Reaction #1340609
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:6]([O:13][C:14]([N:16]1[CH2:20][CH:19]([CH:21]=[CH2:1])[C@H:18]([NH:23][C:24]([O:26][C:27]([CH3:30])([CH3:29])[CH3:28])=[O:25])[CH2:17]1)=[O:15])[C:7]1[CH:12]=[CH:11][CH:10]=[CH:9][CH:8]=1
Reaction #1340610
DOI: 10.6084/m9.figshare.5104873.v1
[C:22]([O:21][C:19]([NH:18][C@H:13]1[CH:14]([CH2:16][CH3:17])[CH2:15][NH:11][CH2:12]1)=[O:20])([CH3:25])([CH3:24])[CH3:23]
Reaction #1340611
DOI: 10.6084/m9.figshare.5104873.v1
[C:3]([O:7][C:8]([NH:10][C@H:11]1[C@@H:15]([CH3:16])[CH2:14][N:13]([C:17]2[C:27]([F:28])=[CH:26][C:20]([C:21]([OH:23])=[O:22])=[C:19]([F:29])[C:18]=2[CH3:30])[CH2:12]1)=[O:9])([CH3:6])([CH3:4])[CH3:5]
Reaction #1340612
DOI: 10.6084/m9.figshare.5104873.v1
[C:13]([O:17][C:18]([NH:20][C@H:21]1[C@@H:25]([CH3:26])[CH2:24][N:23]([C:27]2[C:35]([F:36])=[CH:34][C:30]([C:31](=[O:33])[CH2:40][C:39]([O:45][CH2:46][CH3:47])=[O:44])=[C:29]([F:37])[C:28]=2[CH3:38])[CH2:22]1)=[O:19])([CH3:16])([CH3:15])[CH3:14]
Reaction #1340613
Yield 93.0%DOI: 10.6084/m9.figshare.5104873.v1
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