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Dataset #459

[CH3:94][O:95][C:96]1[CH:105]=[C:104]2[C:99]([CH2:100][CH2:101][C@H:102]([NH2:106])[CH2:103]2)=[CH:98][CH:97]=1
Reaction #2006448
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:94][O:95][C:96]1[CH:105]=[C:104]2[C:99]([CH2:100][CH2:101][C@H:102]([NH2:106])[CH2:103]2)=[CH:98][CH:97]=1
Reaction #2006449
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([N:8]1[CH2:12][CH2:11][CH:10]([NH2:26])[CH2:9]1)([O:3][C:4]([CH3:7])([CH3:6])[CH3:5])=[O:2]
Reaction #2006450
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([N:8]1[CH2:12][CH2:11][C@@H:10]([NH2:30])[CH2:9]1)([O:3][C:4]([CH3:7])([CH3:6])[CH3:5])=[O:2]
Reaction #2006451
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([N:8]1[CH2:13][CH2:12][CH2:11][CH:10]([NH2:27])[CH2:9]1)([O:3][C:4]([CH3:7])([CH3:6])[CH3:5])=[O:2]
Reaction #2006452
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([N:8]1[CH2:13][CH2:12][CH2:11][CH2:10][CH:9]1[NH2:31])([O:3][C:4]([CH3:7])([CH3:6])[CH3:5])=[O:2]
Reaction #2006453
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:3]([N:10]1[CH2:15][CH2:14][CH2:13][C@@H:12]([NH2:16])[CH2:11]1)[C:4]1[CH:5]=[CH:6][CH:7]=[CH:8][CH:9]=1
Reaction #2006454
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][O:2][C:3]1[CH:4]=[C:5]([CH2:11][CH:12]([NH2:27])[CH3:13])[CH:6]=[CH:7][C:8]=1[O:9][CH3:10]
Reaction #2006455
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:1][O:2][C:3]1[CH:8]=[CH:7][C:6]([CH2:9][CH:10]([NH2:29])[CH3:11])=[CH:5][CH:4]=1
Reaction #2006456
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:1]([N:8]1[CH2:12][CH2:11][CH:10]([NH2:30])[CH2:9]1)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1
Reaction #2006457
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:84][O:85][C:86]1[CH:95]=[C:94]2[C:89]([CH2:90][CH2:91][C@H:92]([NH2:96])[CH2:93]2)=[CH:88][CH:87]=1
Reaction #2006458
DOI: 10.6084/m9.figshare.5104873.v1
[NH:1]1[C:12](=[O:13])[NH:11][C:9](=[O:10])[NH:4][C:2]1=[O:3]
Reaction #2006459
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([C:5]1[N:9]=[C:8]([O:10][C:11]2[C:16]([CH3:17])=[CH:15][C:14]([N:18]=[CH:19][N:20]([CH2:22][CH3:23])[CH3:21])=[C:13]([CH3:25])[CH:12]=2)[S:7][N:6]=1)([CH3:4])([CH3:3])[CH3:2]
Reaction #2006460
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([C:5]1[N:9]=[C:8]([O:10][C:11]2[C:17]([CH3:18])=[CH:16][C:14]([N:15]=[CH:23][N:22]([CH2:20][CH3:21])[CH3:24])=[C:13]([CH3:19])[CH:12]=2)[S:7][N:6]=1)([CH3:4])([CH3:3])[CH3:2]
Reaction #2006461
Yield 59.0%DOI: 10.6084/m9.figshare.5104873.v1
[C:13]([C:17]1[N:21]=[C:20]([O:9][C:7]2[C:6]([CH3:10])=[CH:5][C:3]([NH2:4])=[C:2]([CH3:1])[CH:8]=2)[S:19][N:18]=1)([CH3:16])([CH3:15])[CH3:14]
Reaction #2006462
Yield 90.0%DOI: 10.6084/m9.figshare.5104873.v1
[C:2]([C:5]1[N:7]=[C:10]([Cl:9])[S:11][N:6]=1)([CH3:4])([CH3:3])[CH3:1]
Reaction #2006463
Yield 60.0%DOI: 10.6084/m9.figshare.5104873.v1
[C:5]([CH:4]([CH2:1][CH:2]=[CH2:3])[CH2:15][CH:16]=[CH2:17])([O:7][CH2:8][CH3:9])=[O:6]
Reaction #2006464
Yield 78.1%DOI: 10.6084/m9.figshare.5104873.v1
[CH:15]1([C:10]([O:12][CH2:13][CH3:14])=[O:11])[CH2:16][CH:21]=[CH:20][CH2:19]1
Reaction #2006465
Yield 71.1%DOI: 10.6084/m9.figshare.5104873.v1
[Br:1][C:2]1[CH:7]=[CH:6][C:5]([O:34][C:14]2[CH:19]=[CH:18][CH:17]=[CH:16][CH:15]=2)=[CH:4][C:3]=1[CH2:8][O:9][CH2:10][O:11][CH3:12]
Reaction #2006466
DOI: 10.6084/m9.figshare.5104873.v1
[OH:16][B:15]1[C:11]2[CH:10]=[CH:9][C:8]([O:7][C:6]3[CH:5]=[CH:4][C:3]([N:20]4[CH:27]=[N:28][N:22]=[N:21]4)=[CH:19][CH:18]=3)=[CH:17][C:12]=2[CH2:13][O:14]1
Reaction #2006467
Yield 23.0%DOI: 10.6084/m9.figshare.5104873.v1
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