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Dataset #281

[CH2:31]([N:33]([CH2:38][CH3:39])[C:34]([CH2:35][O:1][C:2]1[CH:3]=[CH:4][CH:5]=[C:6]2[C:10]=1[NH:9][CH:8]=[C:7]2[CH2:11][C@H:12]([N:14]1[C:18](=[O:19])[C:17]2=[CH:20][CH:21]=[CH:22][CH:23]=[C:16]2[C:15]1=[O:24])[CH3:13])=[O:37])[CH3:32]
Reaction #1328413
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:31]([N:3]([CH2:1][CH3:2])[C:4]([CH2:6][O:7][C:8]1[CH:9]=[CH:10][CH:11]=[C:12]2[C:16]=1[NH:15][CH:14]=[C:13]2[CH2:17][C@H:18]([NH2:20])[CH3:19])=[O:5])[CH3:32]
Reaction #1328414
Yield 96.0%DOI: 10.6084/m9.figshare.5104873.v1
[CH2:10]([C:18]1[CH:17]=[CH:16][CH:15]=[C:14]([Cl:13])[C:19]=1[CH:20]=[O:21])[CH:9]=[CH2:8]
Reaction #1328415
DOI: 10.6084/m9.figshare.5104873.v1
[CH2:9]([C:12]1[CH:19]=[CH:18][CH:17]=[C:16]([Cl:20])[C:13]=1[CH:14]=[N:7][OH:8])[CH:10]=[CH2:11]
Reaction #1328416
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:16][C:12]1[CH:13]=[CH:14][CH:15]=[C:7]2[C:8]=1[C:9]1=[N:10][O:11][CH2:6][CH:5]1[CH2:4]2
Reaction #1328417
DOI: 10.6084/m9.figshare.5104873.v1
[Br:20][C:11]1[CH:10]=[CH:9][C:8]([S:7][CH3:6])=[C:19]2[C:12]=1[CH2:13][CH:14]1[CH2:18][O:17][N:16]=[C:15]12
Reaction #1328418
DOI: 10.6084/m9.figshare.5104873.v1
[OH:1][C:2]1[N:6]([CH3:7])[N:5]=[CH:4][C:3]=1[C:8]([C:22]1[CH:33]=[CH:32][C:31]([S:34]([CH3:37])(=[O:36])=[O:35])=[C:30]2[C:23]=1[CH2:24][CH:25]1[CH2:29][O:28][N:27]=[C:26]12)=[O:9]
Reaction #1328419
DOI: 10.6084/m9.figshare.5104873.v1
[SH:2][C:5]1[CH:14]=[C:13]([Cl:15])[CH:12]=[CH:11][C:6]=1[C:7]([O:9][CH3:10])=[O:8]
Reaction #1328420
DOI: 10.6084/m9.figshare.5104873.v1
[OH:12][C:10]([CH2:9][CH2:8][S:13][C:14]1[CH:23]=[C:22]([Cl:24])[CH:21]=[CH:20][C:15]=1[C:16]([O:18][CH3:19])=[O:17])=[O:11]
Reaction #1328421
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:17][C:15]1[CH:14]=[CH:13][C:8]([C:9]([O:11][CH3:12])=[O:10])=[C:7]2[C:16]=1[C:2](=[O:3])[CH2:4][CH2:5][S:6]2
Reaction #1328422
DOI: 10.6084/m9.figshare.5104873.v1
[Cl:1][C:2]1[CH:11]=[CH:10][C:9]([C:12]([O:14][CH3:15])=[O:13])=[C:8]2[C:3]=1[C:4](=[O:16])[C:5](=[CH:19][N:20]([CH3:22])[CH3:21])[CH2:6][S:7]2
Reaction #1328423
Yield 97.0%DOI: 10.6084/m9.figshare.5104873.v1
[OH:1][C:2]1[C:11]([CH:15]=[O:16])=[C:10]([O:12][CH3:13])[CH:9]=[CH:8][C:3]=1[C:4]([O:6][CH3:7])=[O:5]
Reaction #1328424
Yield 42.4%DOI: 10.6084/m9.figshare.5104873.v1
[CH2:1]([O:7][C:8]1[C:17]([CH:18]=[O:19])=[C:16]([O:20][CH3:21])[CH:15]=[CH:14][C:9]=1[C:10]([O:12][CH3:13])=[O:11])[CH:2]=[CH2:3]
Reaction #1328425
Yield 36.0%DOI: 10.6084/m9.figshare.5104873.v1
[C:10]([O:12][CH2:13][CH3:14])(=[O:11])/[CH:9]=[CH:15]/[CH:16]=[CH:17]/[CH3:18]
Reaction #1328426
DOI: 10.6084/m9.figshare.5104873.v1
[C:17]([OH:18])(=[O:24])[C:16]1[CH:15]=[CH:22][C:21]([C:26]([OH:29])=[O:28])=[CH:20][CH:19]=1
Reaction #1328427
DOI: 10.6084/m9.figshare.5104873.v1
[C:17]([OH:18])(=[O:24])[C:16]1[CH:15]=[CH:22][C:21]([C:26]([OH:29])=[O:28])=[CH:20][CH:19]=1
Reaction #1328428
DOI: 10.6084/m9.figshare.5104873.v1
[C:17]([OH:18])(=[O:24])[C:16]1[CH:15]=[CH:22][C:21]([C:26]([OH:29])=[O:28])=[CH:20][CH:19]=1
Reaction #1328429
DOI: 10.6084/m9.figshare.5104873.v1
[C:33]([C:32]1[CH:36]=[CH:37][C:29]([CH:28]=[O:38])=[CH:30][CH:31]=1)([OH:35])=[O:34]
Reaction #1328430
Yield 95.6%DOI: 10.6084/m9.figshare.5104873.v1
[C:33]([C:32]1[CH:36]=[CH:37][C:29]([CH:28]=[O:38])=[CH:30][CH:31]=1)([OH:35])=[O:34]
Reaction #1328431
Yield 74.4%DOI: 10.6084/m9.figshare.5104873.v1
[C:33]([C:32]1[CH:36]=[CH:37][C:29]([CH:28]=[O:38])=[CH:30][CH:31]=1)([OH:35])=[O:34]
Reaction #1328432
Yield 70.6%DOI: 10.6084/m9.figshare.5104873.v1
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