← Browse datasets

Dataset #526

[CH3:1][C@@H:2]1[C@H:19]([OH:20])[C@@H:18]([CH3:21])[C:16](=[O:17])[C:15]([CH3:22])([CH3:23])[C@@H:14]([OH:24])[CH2:13][C:11](=[O:12])[O:10][C@H:9](/[C:25](/[CH3:33])=[CH:26]/[C:27]2[N:31]=[C:30]([CH3:32])[S:29][CH:28]=2)[CH2:8][C@@H:7]2[O:37][C@:6]2([CH3:34])[CH2:5][CH2:4][CH2:3]1
Reaction #2348078
DOI: 10.6084/m9.figshare.5104873.v1
[CH3:5][CH:4]([CH2:6][CH2:7][CH2:8][CH:9]([CH3:10])[CH2:11][CH2:12][CH2:13][CH:14]([CH3:16])[CH3:15])[CH2:3][CH2:2][OH:1]
Reaction #2348079
DOI: 10.6084/m9.figshare.5104873.v1
[Br:1][CH2:2][CH2:3][C:4]([F:10])([F:9])[C:5]([F:8])([F:7])[F:6]
Reaction #2348080
DOI: 10.6084/m9.figshare.5104873.v1
[O-:3][P:2]([O:5][O:6][P:7]([O-:10])([O-:9])=[O:8])(=[O:1])[O-:4]
Reaction #2348081
DOI: 10.6084/m9.figshare.5104873.v1
[O:1]=[CH:2][C@@H:3]([C@H:5]([C@@H:7]([C@@H:9]([CH2:11][OH:12])[OH:10])[OH:8])[OH:6])[OH:4]
Reaction #2348082
DOI: 10.6084/m9.figshare.5104873.v1
[F:17][C:18]([F:22])([F:21])[CH2:19][P:7](=[O:8])([C:1]1[CH:2]=[CH:3][CH:4]=[CH:5][CH:6]=1)[C:11]1[CH:12]=[CH:13][CH:14]=[CH:15][CH:16]=1
Reaction #2348083
Yield 51.0%DOI: 10.6084/m9.figshare.5104873.v1
[F:20][C:16]1[CH:15]=[C:14]([C:7]2[CH:8]=[CH:9][C:4]([CH2:1][CH2:2][CH3:3])=[CH:5][CH:6]=2)[CH:19]=[CH:18][CH:17]=1
Reaction #2348084
Yield 80.6%DOI: 10.6084/m9.figshare.5104873.v1
[C:1]1([B:11]([OH:14])[OH:12])[CH:5]=[CH:9][CH:8]=[CH:3][CH:2]=1
Reaction #2348085
DOI: 10.6084/m9.figshare.5104873.v1
[F:19][C:20]1[CH:21]=[C:22]([C:2]2[CH:3]=[CH:4][C:5]([C@H:8]3[CH2:13][CH2:12][C@H:11]([CH2:14][CH2:15][CH2:16][CH2:17][CH3:18])[CH2:10][CH2:9]3)=[CH:6][CH:7]=2)[CH:23]=[CH:24][CH:25]=1
Reaction #2348086
Yield 81.9%DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[C:7]([F:8])=[CH:6][CH:5]=[CH:4][C:3]=1[CH3:11]
Reaction #2348087
DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[C:7]([F:8])=[CH:25][C:24]([CH3:11])=[CH:23][C:27]=1[O:26][B:15]([OH:18])[OH:16]
Reaction #2348088
DOI: 10.6084/m9.figshare.5104873.v1
[F:3][C:4]1[C:9]([F:10])=[CH:8][C:7]([CH3:11])=[CH:6][C:5]=1[OH:12]
Reaction #2348089
DOI: 10.6084/m9.figshare.5104873.v1
[F:13][C:14]1[C:19]([F:20])=[C:18]([O:21][CH2:22][CH3:23])[CH:17]=[C:16]([CH3:24])[C:15]=1[CH:25]=[CH:26][CH:27]1[CH2:32][CH2:31][CH:30]([CH2:33][CH2:34][CH3:35])[CH2:29][CH2:28]1
Reaction #2348090
DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[C:7]([F:8])=[C:6]([O:9][CH2:10][CH3:11])[CH:5]=[C:4]([CH3:12])[C:3]=1[CH2:13][CH2:14][CH:15]1[CH2:20][CH2:19][CH:18]([CH2:21][CH2:22][CH3:23])[CH2:17][CH2:16]1
Reaction #2348091
DOI: 10.6084/m9.figshare.5104873.v1
[F:13][C:14]1[C:19]([F:20])=[C:18]([O:21][CH2:22][CH3:23])[CH:17]=[C:16]([CH3:24])[C:15]=1[CH:25]=[CH:26][CH:27]1[CH2:32][CH2:31][CH:30]([CH2:33][CH2:34][CH2:35][CH2:36][CH3:37])[CH2:29][CH2:28]1
Reaction #2348092
DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[C:7]([F:8])=[C:6]([O:9][CH2:10][CH3:11])[CH:5]=[C:4]([CH3:12])[C:3]=1[CH2:13][CH2:14][CH:15]1[CH2:20][CH2:19][CH:18]([CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])[CH2:17][CH2:16]1
Reaction #2348093
Yield 27.4%DOI: 10.6084/m9.figshare.5104873.v1
[F:13][C:14]1[C:19]([F:20])=[C:18]([O:21][CH2:22][CH3:23])[CH:17]=[C:16]([CH3:24])[C:15]=1[CH:25]=[CH:26][CH:27]1[CH2:32][CH2:31][CH:30]([CH:33]2[CH2:38][CH2:37][CH:36]([CH2:39][CH2:40][CH3:41])[CH2:35][CH2:34]2)[CH2:29][CH2:28]1
Reaction #2348094
DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[C:7]([F:8])=[C:6]([O:9][CH2:10][CH3:11])[CH:5]=[C:4]([CH3:12])[C:3]=1[CH2:13][CH2:14][CH:15]1[CH2:20][CH2:19][CH:18]([CH:21]2[CH2:26][CH2:25][CH:24]([CH2:27][CH2:28][CH3:29])[CH2:23][CH2:22]2)[CH2:17][CH2:16]1
Reaction #2348095
Yield 80.7%DOI: 10.6084/m9.figshare.5104873.v1
[F:13][C:14]1[C:19]([F:20])=[C:18]([O:21][CH2:22][CH3:23])[CH:17]=[C:16]([CH3:24])[C:15]=1[CH:25]=[CH:26][CH:27]1[CH2:32][CH2:31][CH:30]([CH:33]2[CH2:38][CH2:37][CH:36]([CH2:39][CH2:40][CH2:41][CH2:42][CH3:43])[CH2:35][CH2:34]2)[CH2:29][CH2:28]1
Reaction #2348096
DOI: 10.6084/m9.figshare.5104873.v1
[F:1][C:2]1[C:7]([F:8])=[C:6]([O:9][CH2:10][CH3:11])[CH:5]=[C:4]([CH3:12])[C:3]=1[CH2:13][CH2:14][CH:15]1[CH2:20][CH2:19][CH:18]([CH:21]2[CH2:26][CH2:25][CH:24]([CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])[CH2:23][CH2:22]2)[CH2:17][CH2:16]1
Reaction #2348097
Yield 50.1%DOI: 10.6084/m9.figshare.5104873.v1
Page 1Next