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Dataset #506

[S:4]([S:1]([O-:3])=[O:2])([O-:7])(=[O:6])=[O:5]
Reaction #2267050
DOI: 10.6084/m9.figshare.5104873.v1
[NH2:1][CH2:2][C:3]([NH:5][C@@H:6]([C:14]([NH:16][CH2:17][C:18]([NH:20][C@H:21]([C:26]([NH:28][C@H:29]([C:37]([NH:39][C@H:40]([C:44]([OH:46])=[O:45])[CH:41]([CH3:43])[CH3:42])=[O:38])[CH2:30][C:31]1[CH:36]=[CH:35][CH:34]=[CH:33][CH:32]=1)=[O:27])[CH2:22][C:23](=[O:24])[OH:25])=[O:19])=[O:15])[CH2:7][CH2:8][CH2:9][NH:10][C:11](=[NH:12])[NH2:13])=[O:4]
Reaction #2267051
DOI: 10.6084/m9.figshare.5104873.v1
[C:18]([OH:20])(=[O:19])[CH2:17][CH2:16][CH2:15][CH2:14][CH2:13][CH2:12][CH2:11][CH2:9][CH3:8]
Reaction #2267052
DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[C:3]([CH2:18][CH2:19][CH3:20])=[CH:4][CH:5]=[C:6]2[C:15]=1[C:14]([F:16])=[C:13]1[C:8]([CH2:9][CH:10]([CH3:17])[CH2:11][O:12]1)=[CH:7]2
Reaction #2267053
Yield 23.7%DOI: 10.6084/m9.figshare.5104873.v1
[C:10]1([CH3:20])[CH:11]=[CH:12][C:13]([S:16]([OH:19])(=[O:17])=[O:18])=[CH:14][CH:15]=1
Reaction #2267054
DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[C:7]([S:8]([O-:16])(=[O:10])=[O:9])=[C:6]([F:12])[C:5]([F:13])=[C:4]([F:14])[C:3]=1[F:15]
Reaction #2267055
DOI: 10.6084/m9.figshare.5104873.v1
[S:24]([O-:28])([O-:27])(=[O:26])=[O:25]
Reaction #2267056
DOI: 10.6084/m9.figshare.5104873.v1
[F:30][C:31]1[C:36]([S:37]([O-:40])(=[O:39])=[O:38])=[C:35]([F:41])[C:34]([F:42])=[C:33]([F:43])[C:32]=1[F:44]
Reaction #2267057
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:11][CH:7]([CH2:8][CH2:9][CH3:10])[CH2:6][S:15][C:16]1[S:17][C:18]([NH2:21])=[N:19][N:20]=1
Reaction #2267058
DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[C:7]([S:8]([O-:16])(=[O:10])=[O:9])=[C:6]([F:12])[C:5]([F:13])=[C:4]([F:14])[C:3]=1[F:15]
Reaction #2267059
DOI: 10.6084/m9.figshare.5104873.v1
[I:26][C:3]1[C:2]([OH:1])=[CH:11][CH:10]=[C:9]2[C:4]=1[CH:5]=[CH:6][C:7]([C:12]([OH:14])=[O:13])=[CH:8]2
Reaction #2267060
DOI: 10.6084/m9.figshare.5104873.v1
[CH:1]([O:3][CH2:4][CH2:5][O:6][CH2:7][CH:9]1[O:11][CH2:10]1)=[CH2:2]
Reaction #2267061
Yield 60.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH2:3]([C:15]1([OH:16])[CH2:6][CH2:5][CH2:4][CH2:3][CH2:14]1)[CH2:4][C:5]1[CH:10]=[CH:9][CH:8]=[CH:7][CH:6]=1
Reaction #2267062
Yield 96.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH2:1]([C:10]1([OH:16])[CH2:15][CH2:14][CH2:13][CH2:12][CH2:11]1)[CH2:2][C:3]1[CH:8]=[CH:7][CH:6]=[CH:5][CH:4]=1
Reaction #2267063
Yield 96.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][O:2][C:3]1[CH:4]=[C:5]2[C:10](=[CH:11][C:12]=1[O:13][CH3:14])[C@H:9]([CH3:15])[NH:8][CH2:7][CH2:6]2
Reaction #2267064
Yield 99.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][S:2]([CH3:4])=[O:3]
Reaction #2267065
DOI: 10.6084/m9.figshare.5104873.v1
[OH:40][CH2:41][C:42]1([CH2:46][OH:47])[C:36]2[C:35](=[CH:34][CH:33]=[C:32]([CH2:31][C:28]([OH:30])=[O:29])[CH:37]=2)[N:38]=[C:43]1[CH3:44]
Reaction #2267066
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][O:2][C:3]1[CH:4]=[C:5]([CH2:9][CH:10]([OH:12])[CH3:11])[CH:6]=[CH:7][CH:8]=1
Reaction #2267067
Yield 100.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:11][CH:10]1[CH2:9][C:5]2[C:6](=[CH:7][CH:8]=[C:3]([O:2][CH3:1])[CH:4]=2)[CH:20]([C:19]2[CH:22]=[CH:23][C:16]([N+:13]([O-:15])=[O:14])=[CH:17][CH:18]=2)[O:12]1
Reaction #2267068
Yield 93.3%DOI: 10.6084/m9.figshare.5104873.v1
[OH:23][C:4]1([C:14]2[CH:19]=[CH:18][C:17]([N+:20]([O-:22])=[O:21])=[CH:16][CH:15]=2)[C:5]2[C:10](=[CH:9][C:8]([O:12][CH3:13])=[CH:7][CH:6]=2)[CH2:11][CH:2]([CH3:1])[O:3]1
Reaction #2267069
DOI: 10.6084/m9.figshare.5104873.v1
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