← Browse datasets![[Br:31][C:27]1[C:26]([O:32][CH3:33])=[CH:25][CH:24]=[C:23]2[C:28]=1[CH:29]=[CH:30][C:21]([C:18]([OH:20])=[CH:19][C:2](=[O:3])[CH3:1])=[CH:22]2](/api/mol/svg?smiles=%5BBr%3A31%5D%5BC%3A27%5D1%5BC%3A26%5D(%5BO%3A32%5D%5BCH3%3A33%5D)%3D%5BCH%3A25%5D%5BCH%3A24%5D%3D%5BC%3A23%5D2%5BC%3A28%5D%3D1%5BCH%3A29%5D%3D%5BCH%3A30%5D%5BC%3A21%5D(%5BC%3A18%5D(%5BOH%3A20%5D)%3D%5BCH%3A19%5D%5BC%3A2%5D(%3D%5BO%3A3%5D)%5BCH3%3A1%5D)%3D%5BCH%3A22%5D2&w=100&h=80)
![[Br:14][C:10]1[C:9]([O:15][CH3:16])=[CH:8][CH:7]=[C:6]2[C:11]=1[CH:12]=[CH:13][C:4]([C:1]([OH:3])=[CH:2][C:21](=[O:23])[CH3:22])=[CH:5]2](/api/mol/svg?smiles=%5BBr%3A14%5D%5BC%3A10%5D1%5BC%3A9%5D(%5BO%3A15%5D%5BCH3%3A16%5D)%3D%5BCH%3A8%5D%5BCH%3A7%5D%3D%5BC%3A6%5D2%5BC%3A11%5D%3D1%5BCH%3A12%5D%3D%5BCH%3A13%5D%5BC%3A4%5D(%5BC%3A1%5D(%5BOH%3A3%5D)%3D%5BCH%3A2%5D%5BC%3A21%5D(%3D%5BO%3A23%5D)%5BCH3%3A22%5D)%3D%5BCH%3A5%5D2&w=100&h=80)
![[Br:14][C:10]1[C:9]([O:15][CH3:16])=[CH:8][CH:7]=[C:6]2[C:11]=1[CH:12]=[CH:13][C:4]([C:1]([OH:3])=[CH:2][C:17](=[O:19])[CH3:18])=[CH:5]2](/api/mol/svg?smiles=%5BBr%3A14%5D%5BC%3A10%5D1%5BC%3A9%5D(%5BO%3A15%5D%5BCH3%3A16%5D)%3D%5BCH%3A8%5D%5BCH%3A7%5D%3D%5BC%3A6%5D2%5BC%3A11%5D%3D1%5BCH%3A12%5D%3D%5BCH%3A13%5D%5BC%3A4%5D(%5BC%3A1%5D(%5BOH%3A3%5D)%3D%5BCH%3A2%5D%5BC%3A17%5D(%3D%5BO%3A19%5D)%5BCH3%3A18%5D)%3D%5BCH%3A5%5D2&w=100&h=80)
![[CH3:13][O:12][C:11]1[CH:2]=[C:3]2[C:8](=[CH:9][CH:10]=1)[CH:7]=[C:6]([CH2:14][CH2:15][C:16](=[O:18])[CH3:17])[CH:5]=[CH:4]2](/api/mol/svg?smiles=%5BCH3%3A13%5D%5BO%3A12%5D%5BC%3A11%5D1%5BCH%3A2%5D%3D%5BC%3A3%5D2%5BC%3A8%5D(%3D%5BCH%3A9%5D%5BCH%3A10%5D%3D1)%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BCH2%3A14%5D%5BCH2%3A15%5D%5BC%3A16%5D(%3D%5BO%3A18%5D)%5BCH3%3A17%5D)%5BCH%3A5%5D%3D%5BCH%3A4%5D2&w=100&h=80)
![[CH3:13][O:12][C:11]1[CH:2]=[C:3]2[C:8](=[CH:9][CH:10]=1)[CH:7]=[C:6]([CH2:14][CH2:15][C:16](=[O:18])[CH3:17])[CH:5]=[CH:4]2](/api/mol/svg?smiles=%5BCH3%3A13%5D%5BO%3A12%5D%5BC%3A11%5D1%5BCH%3A2%5D%3D%5BC%3A3%5D2%5BC%3A8%5D(%3D%5BCH%3A9%5D%5BCH%3A10%5D%3D1)%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BCH2%3A14%5D%5BCH2%3A15%5D%5BC%3A16%5D(%3D%5BO%3A18%5D)%5BCH3%3A17%5D)%5BCH%3A5%5D%3D%5BCH%3A4%5D2&w=100&h=80)
![[CH3:17][C:16]([CH2:15][CH2:14][C:6]1[CH:5]=[CH:4][C:3]2[CH:2]=[C:11]([O:12][CH3:13])[CH:10]=[CH:9][C:8]=2[CH:7]=1)=[O:18]](/api/mol/svg?smiles=%5BCH3%3A17%5D%5BC%3A16%5D(%5BCH2%3A15%5D%5BCH2%3A14%5D%5BC%3A6%5D1%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BC%3A3%5D2%5BCH%3A2%5D%3D%5BC%3A11%5D(%5BO%3A12%5D%5BCH3%3A13%5D)%5BCH%3A10%5D%3D%5BCH%3A9%5D%5BC%3A8%5D%3D2%5BCH%3A7%5D%3D1)%3D%5BO%3A18%5D&w=100&h=80)
![[NH2:17][CH2:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH:10]=[CH2:11]](/api/mol/svg?smiles=%5BNH2%3A17%5D%5BCH2%3A1%5D%5BCH2%3A2%5D%5BCH2%3A3%5D%5BCH2%3A4%5D%5BCH2%3A5%5D%5BCH2%3A6%5D%5BCH2%3A7%5D%5BCH2%3A8%5D%5BCH2%3A9%5D%5BCH%3A10%5D%3D%5BCH2%3A11%5D&w=100&h=80)
![[C:7]1(=[O:15])[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][NH:17]1](/api/mol/svg?smiles=%5BC%3A7%5D1(%3D%5BO%3A15%5D)%5BCH2%3A8%5D%5BCH2%3A9%5D%5BCH2%3A10%5D%5BCH2%3A11%5D%5BCH2%3A12%5D%5BCH2%3A13%5D%5BCH2%3A14%5D%5BNH%3A17%5D1&w=100&h=80)
![[C:32]1(=[O:42])[N:36]([CH2:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH:10]=[CH2:11])[C:35](=[O:37])[C:34]2=[CH:38][CH:39]=[CH:40][CH:41]=[C:33]12](/api/mol/svg?smiles=%5BC%3A32%5D1(%3D%5BO%3A42%5D)%5BN%3A36%5D(%5BCH2%3A1%5D%5BCH2%3A2%5D%5BCH2%3A3%5D%5BCH2%3A4%5D%5BCH2%3A5%5D%5BCH2%3A6%5D%5BCH2%3A7%5D%5BCH2%3A8%5D%5BCH2%3A9%5D%5BCH%3A10%5D%3D%5BCH2%3A11%5D)%5BC%3A35%5D(%3D%5BO%3A37%5D)%5BC%3A34%5D2%3D%5BCH%3A38%5D%5BCH%3A39%5D%3D%5BCH%3A40%5D%5BCH%3A41%5D%3D%5BC%3A33%5D12&w=100&h=80)
![[CH3:1][C:2]1[S:6][C:5]([C:7]([NH2:10])=[O:8])=[CH:4][CH:3]=1](/api/mol/svg?smiles=%5BCH3%3A1%5D%5BC%3A2%5D1%5BS%3A6%5D%5BC%3A5%5D(%5BC%3A7%5D(%5BNH2%3A10%5D)%3D%5BO%3A8%5D)%3D%5BCH%3A4%5D%5BCH%3A3%5D%3D1&w=100&h=80)
![[Al+3:17]](/api/mol/svg?smiles=%5BAl%2B3%3A17%5D&w=100&h=80)
![[Al+3:21]](/api/mol/svg?smiles=%5BAl%2B3%3A21%5D&w=100&h=80)
(=[O:19])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]/[CH:9]=[CH:10]\[CH2:11]/[CH:12]=[CH:13]\[CH2:14][CH2:15][CH2:16][CH2:17][CH3:18]](/api/mol/svg?smiles=%5BC%3A1%5D(%5BOH%3A20%5D)(%3D%5BO%3A19%5D)%5BCH2%3A2%5D%5BCH2%3A3%5D%5BCH2%3A4%5D%5BCH2%3A5%5D%5BCH2%3A6%5D%5BCH2%3A7%5D%5BCH2%3A8%5D%2F%5BCH%3A9%5D%3D%5BCH%3A10%5D%5C%5BCH2%3A11%5D%2F%5BCH%3A12%5D%3D%5BCH%3A13%5D%5C%5BCH2%3A14%5D%5BCH2%3A15%5D%5BCH2%3A16%5D%5BCH2%3A17%5D%5BCH3%3A18%5D&w=100&h=80)
[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12]](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BS%3A13%5D%5BCl%3A14%5D)%5BCH2%3A2%5D%5BCH2%3A3%5D%5BCH2%3A4%5D%5BCH2%3A5%5D%5BCH2%3A6%5D%5BCH2%3A7%5D%5BCH2%3A8%5D%5BCH2%3A9%5D%5BCH2%3A10%5D%5BCH2%3A11%5D%5BCH3%3A12%5D&w=100&h=80)
[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12]](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BS%3A13%5D%5BCl%3A17%5D)%5BCH2%3A2%5D%5BCH2%3A3%5D%5BCH2%3A4%5D%5BCH2%3A5%5D%5BCH2%3A6%5D%5BCH2%3A7%5D%5BCH2%3A8%5D%5BCH2%3A9%5D%5BCH2%3A10%5D%5BCH2%3A11%5D%5BCH3%3A12%5D&w=100&h=80)
![[C:18]1([C@H:17]([N:24]2[C:11](=[O:12])[C:6]3[C:7](=[C:2]([F:1])[C:3]([F:15])=[C:4]([F:14])[C:5]=3[F:13])[C:8]2=[O:10])[CH3:16])[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=1](/api/mol/svg?smiles=%5BC%3A18%5D1(%5BC%40H%3A17%5D(%5BN%3A24%5D2%5BC%3A11%5D(%3D%5BO%3A12%5D)%5BC%3A6%5D3%5BC%3A7%5D(%3D%5BC%3A2%5D(%5BF%3A1%5D)%5BC%3A3%5D(%5BF%3A15%5D)%3D%5BC%3A4%5D(%5BF%3A14%5D)%5BC%3A5%5D%3D3%5BF%3A13%5D)%5BC%3A8%5D2%3D%5BO%3A10%5D)%5BCH3%3A16%5D)%5BCH%3A23%5D%3D%5BCH%3A22%5D%5BCH%3A21%5D%3D%5BCH%3A20%5D%5BCH%3A19%5D%3D1&w=100&h=80)
![[C:18]1([C@@H:17]([N:24]2[C:11](=[O:12])[C:6]3[C:7](=[C:2]([F:1])[C:3]([F:15])=[C:4]([F:14])[C:5]=3[F:13])[C:8]2=[O:10])[CH3:16])[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=1](/api/mol/svg?smiles=%5BC%3A18%5D1(%5BC%40%40H%3A17%5D(%5BN%3A24%5D2%5BC%3A11%5D(%3D%5BO%3A12%5D)%5BC%3A6%5D3%5BC%3A7%5D(%3D%5BC%3A2%5D(%5BF%3A1%5D)%5BC%3A3%5D(%5BF%3A15%5D)%3D%5BC%3A4%5D(%5BF%3A14%5D)%5BC%3A5%5D%3D3%5BF%3A13%5D)%5BC%3A8%5D2%3D%5BO%3A10%5D)%5BCH3%3A16%5D)%5BCH%3A23%5D%3D%5BCH%3A22%5D%5BCH%3A21%5D%3D%5BCH%3A20%5D%5BCH%3A19%5D%3D1&w=100&h=80)
![[CH:18]1([C@H:17]([N:24]2[C:11](=[O:12])[C:6]3[C:7](=[C:2]([F:1])[C:3]([F:15])=[C:4]([F:14])[C:5]=3[F:13])[C:8]2=[O:10])[CH3:16])[CH2:23][CH2:22][CH2:21][CH2:20][CH2:19]1](/api/mol/svg?smiles=%5BCH%3A18%5D1(%5BC%40H%3A17%5D(%5BN%3A24%5D2%5BC%3A11%5D(%3D%5BO%3A12%5D)%5BC%3A6%5D3%5BC%3A7%5D(%3D%5BC%3A2%5D(%5BF%3A1%5D)%5BC%3A3%5D(%5BF%3A15%5D)%3D%5BC%3A4%5D(%5BF%3A14%5D)%5BC%3A5%5D%3D3%5BF%3A13%5D)%5BC%3A8%5D2%3D%5BO%3A10%5D)%5BCH3%3A16%5D)%5BCH2%3A23%5D%5BCH2%3A22%5D%5BCH2%3A21%5D%5BCH2%3A20%5D%5BCH2%3A19%5D1&w=100&h=80)
![[CH:18]1([C@@H:17]([N:24]2[C:11](=[O:12])[C:6]3[C:7](=[C:2]([F:1])[C:3]([F:15])=[C:4]([F:14])[C:5]=3[F:13])[C:8]2=[O:10])[CH3:16])[CH2:23][CH2:22][CH2:21][CH2:20][CH2:19]1](/api/mol/svg?smiles=%5BCH%3A18%5D1(%5BC%40%40H%3A17%5D(%5BN%3A24%5D2%5BC%3A11%5D(%3D%5BO%3A12%5D)%5BC%3A6%5D3%5BC%3A7%5D(%3D%5BC%3A2%5D(%5BF%3A1%5D)%5BC%3A3%5D(%5BF%3A15%5D)%3D%5BC%3A4%5D(%5BF%3A14%5D)%5BC%3A5%5D%3D3%5BF%3A13%5D)%5BC%3A8%5D2%3D%5BO%3A10%5D)%5BCH3%3A16%5D)%5BCH2%3A23%5D%5BCH2%3A22%5D%5BCH2%3A21%5D%5BCH2%3A20%5D%5BCH2%3A19%5D1&w=100&h=80)
![[C:17]1([C@H:16]([N:23]2[C:10](=[O:11])[C:5]3[C:6](=[CH:12][CH:13]=[CH:14][C:4]=3[N+:1]([O-:3])=[O:2])[C:7]2=[O:9])[CH3:15])[CH:22]=[CH:21][CH:20]=[CH:19][CH:18]=1](/api/mol/svg?smiles=%5BC%3A17%5D1(%5BC%40H%3A16%5D(%5BN%3A23%5D2%5BC%3A10%5D(%3D%5BO%3A11%5D)%5BC%3A5%5D3%5BC%3A6%5D(%3D%5BCH%3A12%5D%5BCH%3A13%5D%3D%5BCH%3A14%5D%5BC%3A4%5D%3D3%5BN%2B%3A1%5D(%5BO-%3A3%5D)%3D%5BO%3A2%5D)%5BC%3A7%5D2%3D%5BO%3A9%5D)%5BCH3%3A15%5D)%5BCH%3A22%5D%3D%5BCH%3A21%5D%5BCH%3A20%5D%3D%5BCH%3A19%5D%5BCH%3A18%5D%3D1&w=100&h=80)
Dataset #537
Reaction #2389075
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389076
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389077
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389078
Yield 52.6%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389079
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389080
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389081
Yield 66.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389082
Yield 65.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389083
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389084
Yield 82.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389085
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389086
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389087
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389088
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389089
DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389090
Yield 65.1%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389091
Yield 74.4%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389092
Yield 64.0%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389093
Yield 65.3%DOI: 10.6084/m9.figshare.5104873.v1
Reaction #2389094
Yield 73.0%DOI: 10.6084/m9.figshare.5104873.v1
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