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Dataset #50

[CH2:1]([C:3]([CH2:7][OH:8])([CH2:5][OH:6])[CH3:4])[OH:2]
Reaction #324367
DOI: 10.6084/m9.figshare.5104873.v1
[S:17]1[CH:21]=[CH:20][CH:19]=[C:18]1[CH:22]=[CH:16][C:7]1[CH:8]=[CH:9][C:10]2[C:5](=[C:4]3[C:13](=[CH:12][CH:11]=2)[CH:14]=[CH:15][C:2]([CH:1]=[CH:22][C:18]2[S:17][CH:21]=[CH:20][CH:19]=2)=[N:3]3)[N:6]=1
Reaction #324368
DOI: 10.6084/m9.figshare.5104873.v1
[S:18]([CH2:13][CH2:14][CH2:15][CH2:16][N+:2]([CH2:3][CH2:4][CH2:5][NH:6][C:7](=[O:11])[C:8]([CH3:10])=[CH2:9])([CH3:12])[CH3:1])([O-:17])(=[O:20])=[O:19]
Reaction #324369
Yield 85.5%DOI: 10.6084/m9.figshare.5104873.v1
[CH:1]1[C:31]([C:30]([OH:27])=[O:34])=[CH:32][C:33]2[C:10]([O:11][C:24](=[O:23])[C:25]=2[CH:2]=1)=[O:9]
Reaction #324370
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([O:5][C:6]1[CH:7]=[CH:8][C:9]([CH:10]=[CH2:11])=[CH:12][CH:13]=1)([CH3:4])([CH3:2])[CH3:3]
Reaction #324371
DOI: 10.6084/m9.figshare.5104873.v1
[OH:5][C:6]1[CH:13]=[CH:12][C:9]([CH:10]=[CH2:11])=[CH:8][CH:7]=1
Reaction #324372
DOI: 10.6084/m9.figshare.5104873.v1
[C:1]([O:4][C:5]1[CH:6]=[CH:12][C:29]([CH:28]=[CH2:27])=[CH:30][CH:31]=1)(=[O:3])[CH3:2]
Reaction #324373
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:11][N:8]([C:7]1[CH:6]=[CH:31][C:30]2[CH:34]=[C:26]([C:99]([CH:98]=[CH2:97])=[O:46])[CH:27]=[CH:28][C:29]=2[CH:63]=1)[CH3:10]
Reaction #324374
DOI: 10.6084/m9.figshare.5104873.v1
[NH:1]([C:17]([O:19][C:20]([CH3:23])([CH3:22])[CH3:21])=[O:18])[C@H:2]([C:14]([O:16][CH3:24])=[O:15])[CH2:3][C:4](=[O:13])[O:5][CH2:6][C:7]1[CH:12]=[CH:11][CH:10]=[CH:9][CH:8]=1
Reaction #324375
Yield 98.0%DOI: 10.6084/m9.figshare.5104873.v1
[OH:34][C:35]1[CH:36]=[CH:37][C:38]([CH2:41][C:42]2[C:43](=[O:44])[N:19]3[CH:20]=[C:15]([C:12]4[CH:11]=[CH:10][C:9]([OH:8])=[CH:14][CH:13]=4)[NH:16][C:17]([C:22]4[S:23][CH:24]=[CH:25][CH:26]=4)=[C:18]3[N:21]=2)=[CH:39][CH:40]=1
Reaction #324376
Yield 22.8%DOI: 10.6084/m9.figshare.5104873.v1
[Si:1]([O:8][C:9]1[CH:14]=[CH:13][C:12]([CH2:15][C:16]([Cl:22])=[O:18])=[CH:11][CH:10]=1)([C:4]([CH3:7])([CH3:6])[CH3:5])([CH3:3])[CH3:2]
Reaction #324377
DOI: 10.6084/m9.figshare.5104873.v1
[Si:28]([O:35][C:36]1[CH:37]=[CH:38][C:39]([CH2:42][C:43]([NH:21][C:18]2[C:17]([C:22]3[CH:27]=[CH:26][CH:25]=[CH:24][CH:23]=3)=[N:16][C:15]([C:12]3[CH:11]=[CH:10][C:9]([O:8][Si:1]([C:4]([CH3:7])([CH3:5])[CH3:6])([CH3:3])[CH3:2])=[CH:14][CH:13]=3)=[CH:20][N:19]=2)=[O:44])=[CH:40][CH:41]=1)([C:31]([CH3:34])([CH3:33])[CH3:32])([CH3:30])[CH3:29]
Reaction #324378
Yield 75.4%DOI: 10.6084/m9.figshare.5104873.v1
[Si:1]([O:8][C:9]1[CH:14]=[CH:13][C:12]([CH2:15][C:16]([Cl:22])=[O:18])=[CH:11][CH:10]=1)([C:4]([CH3:7])([CH3:6])[CH3:5])([CH3:3])[CH3:2]
Reaction #324379
DOI: 10.6084/m9.figshare.5104873.v1
[Si:30]([O:37][C:38]1[CH:39]=[CH:40][C:41]([CH2:44][C:45]([NH:21][C:18]2[C:17](/[CH:22]=[CH:23]/[C:24]3[CH:29]=[CH:28][CH:27]=[CH:26][CH:25]=3)=[N:16][C:15]([C:12]3[CH:11]=[CH:10][C:9]([O:8][Si:1]([C:4]([CH3:7])([CH3:5])[CH3:6])([CH3:2])[CH3:3])=[CH:14][CH:13]=3)=[CH:20][N:19]=2)=[O:46])=[CH:42][CH:43]=1)([C:33]([CH3:36])([CH3:35])[CH3:34])([CH3:32])[CH3:31]
Reaction #324380
Yield 69.7%DOI: 10.6084/m9.figshare.5104873.v1
[Si:1]([O:8][C:9]1[CH:14]=[CH:13][C:12]([CH2:15][C:16]([Cl:22])=[O:18])=[CH:11][CH:10]=1)([C:4]([CH3:7])([CH3:6])[CH3:5])([CH3:3])[CH3:2]
Reaction #324381
DOI: 10.6084/m9.figshare.5104873.v1
[Si:30]([O:37][C:38]1[CH:39]=[CH:40][C:41]([CH2:44][C:45]([NH:21][C:18]2[C:17]([C:22]([C:24]3[CH:29]=[CH:28][CH:27]=[CH:26][CH:25]=3)=[CH2:23])=[N:16][C:15]([C:12]3[CH:11]=[CH:10][C:9]([O:8][Si:1]([C:4]([CH3:7])([CH3:5])[CH3:6])([CH3:2])[CH3:3])=[CH:14][CH:13]=3)=[CH:20][N:19]=2)=[O:46])=[CH:42][CH:43]=1)([C:33]([CH3:36])([CH3:35])[CH3:34])([CH3:32])[CH3:31]
Reaction #324382
Yield 33.3%DOI: 10.6084/m9.figshare.5104873.v1
[Si:1]([O:8][C:9]1[CH:14]=[CH:13][C:12]([CH2:15][C:16]([Cl:22])=[O:18])=[CH:11][CH:10]=1)([C:4]([CH3:7])([CH3:6])[CH3:5])([CH3:3])[CH3:2]
Reaction #324383
DOI: 10.6084/m9.figshare.5104873.v1
[Si:32]([O:39][C:40]1[CH:41]=[CH:42][C:43]([CH2:46][C:47]([NH:21][C:18]2[C:17]([C:22]3[C:31]4[C:26](=[CH:27][CH:28]=[CH:29][CH:30]=4)[CH:25]=[CH:24][CH:23]=3)=[N:16][C:15]([C:12]3[CH:13]=[CH:14][C:9]([O:8][Si:1]([C:4]([CH3:7])([CH3:5])[CH3:6])([CH3:3])[CH3:2])=[CH:10][CH:11]=3)=[CH:20][N:19]=2)=[O:48])=[CH:44][CH:45]=1)([C:35]([CH3:38])([CH3:37])[CH3:36])([CH3:34])[CH3:33]
Reaction #324384
Yield 55.9%DOI: 10.6084/m9.figshare.5104873.v1
[Si:1]([O:8][C:9]1[CH:14]=[CH:13][C:12]([CH2:15][C:16]([Cl:22])=[O:18])=[CH:11][CH:10]=1)([C:4]([CH3:7])([CH3:6])[CH3:5])([CH3:3])[CH3:2]
Reaction #324385
DOI: 10.6084/m9.figshare.5104873.v1
[Si:32]([O:39][C:40]1[CH:41]=[CH:42][C:43]([CH2:46][C:47]([NH:21][C:18]2[C:17]([C:22]3[CH:31]=[CH:30][C:29]4[C:24](=[CH:25][CH:26]=[CH:27][CH:28]=4)[CH:23]=3)=[N:16][C:15]([C:12]3[CH:11]=[CH:10][C:9]([O:8][Si:1]([C:4]([CH3:7])([CH3:5])[CH3:6])([CH3:3])[CH3:2])=[CH:14][CH:13]=3)=[CH:20][N:19]=2)=[O:48])=[CH:44][CH:45]=1)([C:35]([CH3:38])([CH3:37])[CH3:36])([CH3:34])[CH3:33]
Reaction #324386
Yield 58.2%DOI: 10.6084/m9.figshare.5104873.v1
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