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Dataset #302

[NH2:17][CH:13]([CH2:12][NH:11][CH2:10][CH:9]=[C:5]1[C:4](=[O:35])[CH2:3][C:2]([CH3:1])([CH3:36])[CH2:7][C:6]1=[O:8])[C:14]([OH:16])=[O:15]
Reaction #1442502
DOI: 10.6084/m9.figshare.5104873.v1
[CH:33]1[C:34]2[CH2:46][C:41]3[C:40](=[CH:39][CH:44]=[CH:43][CH:42]=3)[C:35]=2[CH:36]=[CH:37][C:47]=1[CH2:48][O:17][C:16]([NH:2][CH2:3][CH2:4][O:5][C:6]1[CH:14]=[CH:13][C:9]([C:10]([OH:12])=[O:11])=[C:8]([OH:15])[CH:7]=1)=[O:19]
Reaction #1442503
DOI: 10.6084/m9.figshare.5104873.v1
[OH:15][C:8]1[CH:7]=[C:6]([O:5][CH2:4][CH2:3][NH:2][C:22]2[N:27]=[CH:26][CH:25]=[CH:24][N:23]=2)[CH:14]=[CH:13][C:9]=1[C:10]([OH:12])=[O:11]
Reaction #1442504
Yield 65.5%DOI: 10.6084/m9.figshare.5104873.v1
[CH2:1]([OH:5])[CH2:2][CH:3]=[CH2:4]
Reaction #1442505
Yield 141.3%DOI: 10.6084/m9.figshare.5104873.v1
[O:1]=[CH:2][C@@H:3]([C@H:5]([C@@H:7]([CH2:9][OH:10])[OH:8])[OH:6])[OH:4]
Reaction #1442506
DOI: 10.6084/m9.figshare.5104873.v1
[O:5]=[CH:6][C@@H:7]([C@H:9]([C@H:11]([CH2:13][OH:14])[OH:12])[OH:10])[OH:8]
Reaction #1442507
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:56][N:55]([CH3:57])[O:54][CH2:53][CH2:52][O:51][C@@H:39]1[C@H:38]([OH:58])[C@@H:37]([CH2:36][OH:35])[O:41][C@H:40]1[N:42]1[CH:49]=[C:48]([CH3:50])[C:46](=[O:47])[NH:45][C:43]1=[O:44]
Reaction #1442508
Yield 92.5%DOI: 10.6084/m9.figshare.5104873.v1
[C:13]1([S:19]([N:6]2[C:7]3[C:12](=[CH:11][CH:10]=[CH:9][CH:8]=3)[C:4]([CH3:3])=[CH:5]2)(=[O:21])=[O:20])[CH:18]=[CH:17][CH:16]=[CH:15][CH:14]=1
Reaction #1442509
Yield 85.0%DOI: 10.6084/m9.figshare.5104873.v1
[OH:1][CH:2]([CH3:9])[CH2:3][C:4]([O:6][CH2:7][CH3:8])=[O:5]
Reaction #1442510
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][C:2]1[C:3]2[C:7](=[O:8])[CH2:6][O:5][C:4]=2[CH:10]=[C:11]([CH3:13])[CH:12]=1
Reaction #1442511
Yield 100.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][C:2]1[C:7]2[C:8]([Br:14])=[CH:9][O:10][C:6]=2[CH:5]=[C:4]([CH3:12])[CH:3]=1
Reaction #1442512
Yield 60.0%DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([O-:24])(=[O:23])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22]
Reaction #1442513
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:16][C:12]1[C:11](=[O:13])[O:10][C:8](=[O:9])[C:7]=1[C:1]1[CH:2]=[CH:3][CH:4]=[CH:5][CH:6]=1
Reaction #1442514
DOI: 10.6084/m9.figshare.5104873.v1
[NH:21]([N:22]1[C:5](=[O:13])[C:6]([C:7]2[CH:8]=[CH:9][CH:10]=[CH:11][CH:12]=2)=[C:2]([Cl:1])[C:3]1=[O:14])[C:15]1[CH:20]=[CH:19][CH:18]=[CH:17][CH:16]=1
Reaction #1442515
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:1][C:2]1[C:3](=[O:14])[N:24]([NH:23][C:20]2[CH:21]=[CH:22][C:17]([F:16])=[CH:18][CH:19]=2)[C:5](=[O:13])[C:6]=1[C:7]1[CH:8]=[CH:9][CH:10]=[CH:11][CH:12]=1
Reaction #1442516
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:6][C:7]1[CH:12]=[CH:11][C:10]([C:13]([C:14]#[N:15])=[CH:2][C:1]([O-:5])=[O:4])=[CH:9][CH:8]=1
Reaction #1442517
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:6][C:7]1[CH:12]=[CH:11][C:10]([C:13]2[C:18](=[O:2])[O:16][C:15](=[O:17])[CH:14]=2)=[CH:9][CH:8]=1
Reaction #1442518
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:17][C:12]1[C:11](=[O:13])[O:10][C:9](=[O:14])[C:8]=1[C:5]1[CH:4]=[CH:3][C:2]([Cl:1])=[CH:7][CH:6]=1
Reaction #1442519
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:1][C:2]1[C:3](=[O:15])[N:18]([N:17]([CH3:16])[C:19]2[CH:24]=[CH:23][CH:22]=[CH:21][CH:20]=2)[C:5](=[O:14])[C:6]=1[C:7]1[CH:8]=[CH:9][C:10]([Cl:13])=[CH:11][CH:12]=1
Reaction #1442520
DOI: 10.6084/m9.figshare.5104873.v1
[Br:3][C:22]1[C:21](=[O:23])[O:20][C:18](=[O:19])[C:17]=1[C:11]1[CH:12]=[CH:13][CH:14]=[CH:15][CH:16]=1
Reaction #1442521
DOI: 10.6084/m9.figshare.5104873.v1
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