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Dataset #65

[CH3:20][CH:16]1[CH2:21][C:13]2[C:12](=[CH:11][CH:10]=[C:9]([CH2:5][CH:6]([CH3:8])[CH3:7])[CH:14]=2)[C:17]1=[O:18]
Reaction #362814
Yield 83.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:3][C:4]1[CH2:12][C:11]2[C:6]([CH:5]=1)=[CH:7][CH:8]=[C:9]([CH2:13][CH:14]([CH3:16])[CH3:15])[CH:10]=2
Reaction #362815
Yield 95.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][C:2]1[CH2:3][C:4]2[C:9]([CH:10]=1)=[CH:8][CH:7]=[C:6]([C:11]([CH3:14])([CH3:13])[CH3:12])[CH:5]=2
Reaction #362816
Yield 99.1%DOI: 10.6084/m9.figshare.5104873.v1
[CH2:16]([O:20][C:21]1[CH:22]=[CH:23][C:24]([C:25]([CH:2]2[CH2:3][CH2:4][CH2:5][CH2:6][NH:7][C:1]2=[O:8])=[O:26])=[CH:28][CH:29]=1)[CH2:17][CH2:18][CH3:19]
Reaction #362817
Yield 561.5%DOI: 10.6084/m9.figshare.5104873.v1
[NH2:3][C:4]1[CH:9]=[C:8]([Cl:11])[N:7]=[C:6]([C:12]([OH:14])=[O:13])[C:5]=1[Cl:15]
Reaction #362818
DOI: 10.6084/m9.figshare.5104873.v1
[C:1](=[O:2])([O-:4])[O-:3]
Reaction #362819
DOI: 10.6084/m9.figshare.5104873.v1
[CH:14]1[C:15]2[C:10](=[CH:9][CH:8]=[CH:7][CH:6]=2)[CH:11]=[CH:12][C:13]=1[S:1]([OH:3])(=[O:5])=[O:2]
Reaction #362820
DOI: 10.6084/m9.figshare.5104873.v1
[P:1]([Cl:14])(=[O:12])([O:2][C:3]1[CH:4]=[CH:5][C:6]([N+:9]([O-:11])=[O:10])=[CH:7][CH:8]=1)[O:31][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20]
Reaction #362821
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([O:6][CH2:7][CH2:28][CH2:27][CH2:26][CH2:25][CH2:24][CH2:23][CH2:22][CH2:21][CH2:20][CH2:19][CH2:18][CH2:17][CH2:16][CH2:15][CH2:14][CH2:13][CH2:12][CH2:11][CH2:10][CH2:9][CH3:8])(=[O:5])[CH:2]([CH3:4])[OH:3]
Reaction #362822
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:31][B:30]([Cl:32])[C:2]1[CH:7]=[C:6]([F:8])[CH:5]=[C:4]([F:9])[CH:3]=1
Reaction #362823
Yield 81.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][CH2:2][CH:4]([CH2:5][CH2:6][C:16]([OH:20])([CH2:17][CH3:18])[CH3:23])[CH3:9]
Reaction #362824
DOI: 10.6084/m9.figshare.5104873.v1
[I:15][C:6]1[CH:5]=[C:4]([S:3][CH3:2])[CH:10]=[CH:9][CH:8]=1
Reaction #362825
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([C:5]1[CH:12]=[CH:11][C:8]([CH2:9][CH2:23][C:22]([NH:25][CH:26]([C:32]([O:34][CH2:35][CH3:36])=[O:33])[C:27]([O:29][CH2:30][CH3:31])=[O:28])=[O:24])=[CH:7][CH:6]=1)([CH3:4])([CH3:3])[CH3:2]
Reaction #362826
Yield 68.5%DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([NH:4][CH:5]([C:14]([O:16][CH2:17][CH3:18])=[O:15])[CH2:6][C:7]1[CH:8]=[CH:9][CH:10]=[C:34]([N:32]([CH3:31])[CH3:33])[CH:12]=1)(=[O:3])[CH3:2]
Reaction #362827
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:24]([N:1]([CH2:36][CH:33]=[CH2:34])[C:2]1[CH:3]=[CH:4][C:5]([CH2:6][CH2:7][C:8]([NH:10][CH:11]([C:17]([O:19][CH2:20][CH3:21])=[O:18])[C:12]([O:14][CH2:15][CH3:16])=[O:13])=[O:9])=[CH:22][CH:23]=1)[CH:25]=[CH2:26]
Reaction #362828
DOI: 10.6084/m9.figshare.5104873.v1
[N:1]1([C:2]2[CH:3]=[CH:4][C:5]([CH2:6][CH2:7][C:8]([NH:10][CH:11]([C:17]([O:19][CH2:20][CH3:21])=[O:18])[C:12]([O:14][CH2:15][CH3:16])=[O:13])=[O:9])=[CH:22][CH:23]=2)[CH:31]=[CH:35][CH:34]=[CH:33]1
Reaction #362829
DOI: 10.6084/m9.figshare.5104873.v1
[ClH:20]
Reaction #362830
Yield 77.6%DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([O:5][C:6]([NH:8][C@H:9]([C:18]([OH:20])=[O:19])[CH2:10][C:11]1[CH:12]=[CH:13][C:14]([O:17][CH2:33][CH2:34][Cl:35])=[CH:15][CH:16]=1)=[O:7])([CH3:4])([CH3:2])[CH3:3]
Reaction #362831
Yield 79.0%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 #362832
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 #362833
DOI: 10.6084/m9.figshare.5104873.v1
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