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Dataset #436

[CH3:1][C:2]1[C:7](=[N:9][OH:10])[CH:6]=[CH:5][C:4](=[O:8])[CH:3]=1
Reaction #1914808
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][C:2]1[C:3](=[O:8])[CH:4]=[CH:5][C:6](=[N:9][OH:10])[CH:7]=1
Reaction #1914809
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:1][C:2]1[C:3](=[O:8])[CH:4]=[CH:5][C:6](=[N:9][OH:10])[CH:7]=1
Reaction #1914810
DOI: 10.6084/m9.figshare.5104873.v1
[C:11]([O:9][N:8]=[C:7]1[CH:6]=[CH:5][C:4](=[O:10])[CH:3]=[C:2]1[CH3:1])(=[O:13])[CH3:12]
Reaction #1914811
DOI: 10.6084/m9.figshare.5104873.v1
[N:4]1[CH:5]=[CH:6][CH:7]=[CH:8][C:3]=1[N:1]1[C:14]([NH2:15])=[CH:13][CH:12]=[N:2]1
Reaction #1914812
Yield 5.3%DOI: 10.6084/m9.figshare.5104873.v1
[N:14]([C:11]1[CH:10]=[N:9][N:8]([C:3]2[CH:4]=[CH:5][CH:6]=[CH:7][N:2]=2)[C:12]=1[NH2:13])=[O:15]
Reaction #1914813
Yield 81.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH2:2]([N:4]([CH2:9][CH3:10])[CH2:5][C:6]([OH:8])=[O:7])[CH3:3]
Reaction #1914814
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:15][C:16]1([CH3:17])[C:18]([CH3:20])([CH3:19])[O:8][C:1]1([C:9]1[CH:14]=[CH:13][CH:12]=[CH:11][CH:10]=1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1
Reaction #1914815
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:7][CH:6]1[C:3]([CH2:2][O:24][C:13]2[CH:12]=[CH:11][C:16]([C:17]3[CH:22]=[CH:21][C:20]([O:23][CH2:2][C:3]4([CH2:9][CH3:10])[CH:6]([CH3:7])[O:25][CH:4]4[CH3:8])=[CH:19][CH:18]=3)=[CH:15][CH:14]=2)([CH2:9][CH3:10])[CH:4]([CH3:8])[O:5]1
Reaction #1914816
DOI: 10.6084/m9.figshare.5104873.v1
[OH:15][CH2:14][CH:10]1[O:9][C:8]2=[C:7]([C:19]([OH:21])=[O:20])[S:6][C:5]([C:3]([OH:4])=[O:2])=[C:13]2[O:12][CH2:11]1
Reaction #1914817
DOI: 10.6084/m9.figshare.5104873.v1
[O:8]1[CH:3]([CH2:2][OH:1])[CH2:4][O:5][C:6]2=[CH:11][S:10][CH:9]=[C:7]12
Reaction #1914818
DOI: 10.6084/m9.figshare.5104873.v1
[Na+:13]
Reaction #1914819
DOI: 10.6084/m9.figshare.5104873.v1
[C:5]([C:13]1[CH:14]=[CH:15][C:10]([I:9])=[CH:11][C:12]=1[CH3:16])(=[O:7])[CH3:6]
Reaction #1914820
Yield 51.2%DOI: 10.6084/m9.figshare.5104873.v1
[CH:9]([N:12]([P:2]([Cl:1])[O:3][CH2:4][CH2:5][C:6]#[N:7])[CH:15]([CH3:17])[CH3:16])([CH3:11])[CH3:10]
Reaction #1914821
DOI: 10.6084/m9.figshare.5104873.v1
[CH:9]([N:12]([P:2]([Cl:1])[O:3][CH2:4][CH2:5][C:6]#[N:7])[CH:15]([CH3:17])[CH3:16])([CH3:11])[CH3:10]
Reaction #1914822
DOI: 10.6084/m9.figshare.5104873.v1
[Br:20][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][C:17]([OH:19])=[O:18]
Reaction #1914823
Yield 99.0%DOI: 10.6084/m9.figshare.5104873.v1
[SH:2][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][C:27]([OH:29])=[O:28]
Reaction #1914824
Yield 97.2%DOI: 10.6084/m9.figshare.5104873.v1
[Br: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][CH2:22][CH2:23][OH:24]
Reaction #1914825
Yield 93.2%DOI: 10.6084/m9.figshare.5104873.v1
[SH:2][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][OH:28]
Reaction #1914826
Yield 70.3%DOI: 10.6084/m9.figshare.5104873.v1
[I:13][C:7]1[CH:8]=[CH:9][C:4]([CH2:3][C@@H:2]([C:10]([OH:12])=[O:11])[NH2:1])=[CH:5][CH:6]=1
Reaction #1914827
Yield 132.8%DOI: 10.6084/m9.figshare.5104873.v1
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