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Dataset #288

[CH3:9][C:5]1[CH:4]=[CH:3][C:2]([NH:1][CH2:15][C:11]2[NH:10][CH:14]=[CH:13][CH:12]=2)=[CH:7][C:6]=1[OH:8]
Reaction #1350558
Yield 41.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:9][C:5]1[CH:4]=[CH:3][C:2]([N:1]([C:11]2[O:10][CH:14]=[CH:13][CH:12]=2)[CH3:17])=[CH:7][C:6]=1[OH:8]
Reaction #1350559
Yield 83.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:9][C:5]1[CH:4]=[CH:3][C:2]([N:1]([C:11]2[S:10][CH:14]=[CH:13][CH:12]=2)[CH3:17])=[CH:7][C:6]=1[OH:8]
Reaction #1350560
Yield 32.5%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:10][C:9]1([CH3:13])[NH:8][C:1]2([CH2:6][CH2:5][CH2:4][CH2:3][CH2:2]2)[O:7][CH2:12]1
Reaction #1350561
Yield 81.4%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:7][C:8]1([CH3:10])[NH:1][C:2]([CH3:6])([CH3:5])[CH2:3][O:4]1
Reaction #1350562
Yield 77.5%DOI: 10.6084/m9.figshare.5104873.v1
[CH:6]1([N:1]2[CH2:5][CH2:4][CH2:3][CH2:2]2)[CH2:13][CH2:12][CH2:11][CH2:10][CH2:9][CH2:8][CH2:7]1
Reaction #1350563
DOI: 10.6084/m9.figshare.5104873.v1
[I-:18]
Reaction #1350564
Yield 90.0%DOI: 10.6084/m9.figshare.5104873.v1
[OH-:19]
Reaction #1350565
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:9][C:8]1[N:1]=[C:2]([Cl:3])[N:4]=[C:5]([NH:18][CH2:15][CH2:16][CH3:17])[N:7]=1
Reaction #1350566
DOI: 10.6084/m9.figshare.5104873.v1
[O:22]=[CH:5][C@@H:6]([C@H:32]([C@@H:30]([C@@H:28]([CH2:25][OH:27])[OH:29])[OH:31])[OH:34])[OH:7]
Reaction #1350567
DOI: 10.6084/m9.figshare.5104873.v1
[NH2:19][C@H:20]([C:26]([OH:28])=[O:27])[CH2:21][CH2:22][C:23]([OH:25])=[O:24]
Reaction #1350568
DOI: 10.6084/m9.figshare.5104873.v1
[O:73]([CH2:21]/[CH:22]=[C:23](/[CH2:26][CH2:27][CH2:28][C@@H:29]([CH2:31][CH2:32][CH2:33][C@@H:34]([CH2:36][CH2:37][CH2:38][CH:39]([CH3:41])[CH3:40])[CH3:35])[CH3:30])\[CH3:25])[P:72]([O:75][P:72]([O-:74])([O-:73])=[O:71])(=[O:74])[O-:71]
Reaction #1350569
DOI: 10.6084/m9.figshare.5104873.v1
[Br:25][C:24]1[C:20]([C:16]2[CH:15]=[C:14]([NH:13][C:10]([O:9][C:6]3[CH:7]=[CH:8][C:3]([O:2][CH3:1])=[CH:4][CH:5]=3)=[O:11])[CH:19]=[CH:18][CH:17]=2)=[N:21][N:22]([CH3:26])[CH:23]=1
Reaction #1350570
Yield 59.7%DOI: 10.6084/m9.figshare.5104873.v1
[Br:27][C:26]1[C:22]([C:18]2[CH:17]=[C:16]([NH:15][C:8]([C:7]3[CH:11]=[CH:12][C:4]([O:3][C:2]([F:14])([F:13])[F:1])=[CH:5][CH:6]=3)=[O:9])[CH:21]=[CH:20][CH:19]=2)=[N:23][N:24]([CH3:28])[CH:25]=1
Reaction #1350571
Yield 76.0%DOI: 10.6084/m9.figshare.5104873.v1
[Br:25][C:24]1[C:20]([C:16]2[CH:15]=[C:14]([NH:13][C:2]([NH:42][CH2:41][C:40]3[CH:43]=[CH:44][C:37]([O:36][C:35]([F:45])([F:46])[F:34])=[CH:38][CH:39]=3)=[O:4])[CH:19]=[CH:18][CH:17]=2)=[N:21][N:22]([CH3:26])[CH:23]=1
Reaction #1350572
Yield 202.4%DOI: 10.6084/m9.figshare.5104873.v1
[Br:23][C:22]1[C:18]([C:14]2[CH:13]=[C:12]([NH:11][C:6]([C:5]3[CH:9]=[CH:10][C:2]([Cl:1])=[CH:3][CH:4]=3)=[O:7])[CH:17]=[CH:16][CH:15]=2)=[N:19][N:20]([CH3:24])[CH:21]=1
Reaction #1350573
Yield 73.6%DOI: 10.6084/m9.figshare.5104873.v1
[Br:13][C:12]1[C:8]([C:4]2[CH:3]=[C:2]([NH:1][C:32](=[O:33])[CH2:31][C:28]3[CH:29]=[CH:30][C:25]([O:24][C:23]([F:35])([F:22])[F:36])=[CH:26][CH:27]=3)[CH:7]=[CH:6][CH:5]=2)=[N:9][N:10]([CH3:14])[CH:11]=1
Reaction #1350574
Yield 68.0%DOI: 10.6084/m9.figshare.5104873.v1
[Br:13][C:12]1[C:8]([C:4]2[CH:3]=[C:2]([NH:1][C:23](=[O:24])[CH2:22][C:18]3[CH:19]=[CH:20][CH:21]=[C:16]([F:15])[CH:17]=3)[CH:7]=[CH:6][CH:5]=2)=[N:9][N:10]([CH3:14])[CH:11]=1
Reaction #1350575
Yield 26.0%DOI: 10.6084/m9.figshare.5104873.v1
[Br:25][C:24]1[C:20]([C:16]2[CH:15]=[C:14]([NH:13][C:10](=[O:11])[CH2:9][C:5]3[CH:6]=[CH:7][CH:8]=[C:3]([O:2][CH3:1])[CH:4]=3)[CH:19]=[CH:18][CH:17]=2)=[N:21][N:22]([CH3:26])[CH:23]=1
Reaction #1350576
Yield 19.0%DOI: 10.6084/m9.figshare.5104873.v1
[Br:13][C:12]1[C:8]([C:4]2[CH:3]=[C:2]([NH:1][C:23](=[O:24])[CH2:22][C:17]3[CH:18]=[CH:19][CH:20]=[CH:21][C:16]=3[F:15])[CH:7]=[CH:6][CH:5]=2)=[N:9][N:10]([CH3:14])[CH:11]=1
Reaction #1350577
Yield 32.2%DOI: 10.6084/m9.figshare.5104873.v1
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