← 浏览数据集![[NH2:18][C@H:9]([C:11]([OH:12])=[O:37])[CH2:7][CH2:5][CH2:3][NH:20][C:21](=[NH:23])[NH2:19]](/api/mol/svg?smiles=%5BNH2%3A18%5D%5BC%40H%3A9%5D(%5BC%3A11%5D(%5BOH%3A12%5D)%3D%5BO%3A37%5D)%5BCH2%3A7%5D%5BCH2%3A5%5D%5BCH2%3A3%5D%5BNH%3A20%5D%5BC%3A21%5D(%3D%5BNH%3A23%5D)%5BNH2%3A19%5D&w=100&h=80)
![[NH2:18][C@H:9]([C:11]([OH:12])=[O:33])[CH2:7][C:5]1[C:3]2[C:56](=[CH:61][CH:53]=[CH:52][CH:2]=2)[NH:57][CH:58]=1](/api/mol/svg?smiles=%5BNH2%3A18%5D%5BC%40H%3A9%5D(%5BC%3A11%5D(%5BOH%3A12%5D)%3D%5BO%3A33%5D)%5BCH2%3A7%5D%5BC%3A5%5D1%5BC%3A3%5D2%5BC%3A56%5D(%3D%5BCH%3A61%5D%5BCH%3A53%5D%3D%5BCH%3A52%5D%5BCH%3A2%5D%3D2)%5BNH%3A57%5D%5BCH%3A58%5D%3D1&w=100&h=80)
![[CH3:3][C:2]([CH3:5])([CH3:4])[C:1]([NH:8][C:9]1[CH:14]=[CH:13][N:12]=[CH:11][CH:10]=1)=[O:6]](/api/mol/svg?smiles=%5BCH3%3A3%5D%5BC%3A2%5D(%5BCH3%3A5%5D)(%5BCH3%3A4%5D)%5BC%3A1%5D(%5BNH%3A8%5D%5BC%3A9%5D1%5BCH%3A14%5D%3D%5BCH%3A13%5D%5BN%3A12%5D%3D%5BCH%3A11%5D%5BCH%3A10%5D%3D1)%3D%5BO%3A6%5D&w=100&h=80)
![[C:26]1([C:23]2[CH:24]=[C:5]([C:4]([OH:20])=[O:3])[C:7]3[C:12](=[CH:11][CH:10]=[N:9][CH:8]=3)[N:13]=2)[CH:31]=[CH:30][CH:29]=[CH:28][CH:27]=1](/api/mol/svg?smiles=%5BC%3A26%5D1(%5BC%3A23%5D2%5BCH%3A24%5D%3D%5BC%3A5%5D(%5BC%3A4%5D(%5BOH%3A20%5D)%3D%5BO%3A3%5D)%5BC%3A7%5D3%5BC%3A12%5D(%3D%5BCH%3A11%5D%5BCH%3A10%5D%3D%5BN%3A9%5D%5BCH%3A8%5D%3D3)%5BN%3A13%5D%3D2)%5BCH%3A31%5D%3D%5BCH%3A30%5D%5BCH%3A29%5D%3D%5BCH%3A28%5D%5BCH%3A27%5D%3D1&w=100&h=80)
![[CH3:9][C:10]1[CH:15]=[C:22]([C:21]2[CH:24]=[CH:25][C:18]([S:17][CH3:16])=[CH:19][CH:20]=2)[NH:23][C:12](=[O:13])[CH:11]=1](/api/mol/svg?smiles=%5BCH3%3A9%5D%5BC%3A10%5D1%5BCH%3A15%5D%3D%5BC%3A22%5D(%5BC%3A21%5D2%5BCH%3A24%5D%3D%5BCH%3A25%5D%5BC%3A18%5D(%5BS%3A17%5D%5BCH3%3A16%5D)%3D%5BCH%3A19%5D%5BCH%3A20%5D%3D2)%5BNH%3A23%5D%5BC%3A12%5D(%3D%5BO%3A13%5D)%5BCH%3A11%5D%3D1&w=100&h=80)
![[CH3:9][S:10]([C:13]1[CH:18]=[CH:17][C:16]([C:2]2[CH:7]=[C:6]([CH3:8])[CH:5]=[CH:4][N:3]=2)=[CH:15][CH:14]=1)(=[O:12])=[O:11]](/api/mol/svg?smiles=%5BCH3%3A9%5D%5BS%3A10%5D(%5BC%3A13%5D1%5BCH%3A18%5D%3D%5BCH%3A17%5D%5BC%3A16%5D(%5BC%3A2%5D2%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BCH3%3A8%5D)%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BN%3A3%5D%3D2)%3D%5BCH%3A15%5D%5BCH%3A14%5D%3D1)(%3D%5BO%3A12%5D)%3D%5BO%3A11%5D&w=100&h=80)
=[N:6][CH:5]=[N:4]1)[CH3:2]](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BN%3A3%5D1%5BC%3A7%5D(%5BCH%3A24%5D%3D%5BO%3A25%5D)%3D%5BN%3A6%5D%5BCH%3A5%5D%3D%5BN%3A4%5D1)%5BCH3%3A2%5D&w=100&h=80)
=[N:6][CH:5]=[N:4]1)[CH3:2]](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BN%3A3%5D1%5BC%3A7%5D(%5BCH%3A8%5D%3D%5BN%3A11%5D%5BOH%3A12%5D)%3D%5BN%3A6%5D%5BCH%3A5%5D%3D%5BN%3A4%5D1)%5BCH3%3A2%5D&w=100&h=80)
(=[O:13])[CH3:12]](/api/mol/svg?smiles=%5BC%3A11%5D(%5BO-%3A10%5D)(%3D%5BO%3A13%5D)%5BCH3%3A12%5D&w=100&h=80)
![[CH3:12][S:13][C:14]1[CH:19]=[CH:18][C:17]([C:2]2[CH:7]=[C:6]([C:8]([F:11])([F:10])[F:9])[CH:5]=[CH:4][N:3]=2)=[CH:16][CH:15]=1](/api/mol/svg?smiles=%5BCH3%3A12%5D%5BS%3A13%5D%5BC%3A14%5D1%5BCH%3A19%5D%3D%5BCH%3A18%5D%5BC%3A17%5D(%5BC%3A2%5D2%5BCH%3A7%5D%3D%5BC%3A6%5D(%5BC%3A8%5D(%5BF%3A11%5D)(%5BF%3A10%5D)%5BF%3A9%5D)%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BN%3A3%5D%3D2)%3D%5BCH%3A16%5D%5BCH%3A15%5D%3D1&w=100&h=80)
![[F:13][C:14]([F:22])([F:21])[C:15]1[CH:20]=[C:29]([C:28]2[CH:31]=[CH:32][C:25]([S:24][CH3:23])=[CH:26][CH:27]=2)[NH:30][C:17](=[O:18])[CH:16]=1](/api/mol/svg?smiles=%5BF%3A13%5D%5BC%3A14%5D(%5BF%3A22%5D)(%5BF%3A21%5D)%5BC%3A15%5D1%5BCH%3A20%5D%3D%5BC%3A29%5D(%5BC%3A28%5D2%5BCH%3A31%5D%3D%5BCH%3A32%5D%5BC%3A25%5D(%5BS%3A24%5D%5BCH3%3A23%5D)%3D%5BCH%3A26%5D%5BCH%3A27%5D%3D2)%5BNH%3A30%5D%5BC%3A17%5D(%3D%5BO%3A18%5D)%5BCH%3A16%5D%3D1&w=100&h=80)
![[CH3:1][S:2][C:3]1[CH:4]=[CH:5][C:6]([C:7]([N:23]2[CH2:28][CH2:27][O:26][CH2:25][CH2:24]2)=[O:9])=[CH:10][CH:11]=1](/api/mol/svg?smiles=%5BCH3%3A1%5D%5BS%3A2%5D%5BC%3A3%5D1%5BCH%3A4%5D%3D%5BCH%3A5%5D%5BC%3A6%5D(%5BC%3A7%5D(%5BN%3A23%5D2%5BCH2%3A28%5D%5BCH2%3A27%5D%5BO%3A26%5D%5BCH2%3A25%5D%5BCH2%3A24%5D2)%3D%5BO%3A9%5D)%3D%5BCH%3A10%5D%5BCH%3A11%5D%3D1&w=100&h=80)
([CH3:3])[CH3:2]](/api/mol/svg?smiles=%5BCH%3A1%5D(%5BNH%3A4%5D%5BC%3A5%5D1%5BCH%3A10%5D%3D%5BCH%3A9%5D%5BCH%3A8%5D%3D%5BCH%3A7%5D%5BC%3A6%5D%3D1%5BCH%3A11%5D%3D%5BO%3A12%5D)(%5BCH3%3A3%5D)%5BCH3%3A2%5D&w=100&h=80)
[CH:17]=[C:5]([C:6]([OH:7])=[O:8])[C:4]1=[O:9])([CH3:13])[CH3:12]](/api/mol/svg?smiles=%5BCH%3A11%5D(%5BN%3A14%5D1%5BC%3A15%5D2%5BC%3A16%5D(%3D%5BCH%3A19%5D%5BCH%3A20%5D%3D%5BCH%3A21%5D%5BCH%3A22%5D%3D2)%5BCH%3A17%5D%3D%5BC%3A5%5D(%5BC%3A6%5D(%5BOH%3A7%5D)%3D%5BO%3A8%5D)%5BC%3A4%5D1%3D%5BO%3A9%5D)(%5BCH3%3A13%5D)%5BCH3%3A12%5D&w=100&h=80)
[CH:40]=[C:2]([C:3]([OH:5])=[O:4])[C:35]1=[O:37])([CH3:23])[CH3:24]](/api/mol/svg?smiles=%5BCH%3A22%5D(%5BN%3A18%5D1%5BC%3A19%5D2%5BC%3A20%5D(%3D%5BCH%3A10%5D%5BCH%3A11%5D%3D%5BCH%3A12%5D%5BCH%3A21%5D%3D2)%5BCH%3A40%5D%3D%5BC%3A2%5D(%5BC%3A3%5D(%5BOH%3A5%5D)%3D%5BO%3A4%5D)%5BC%3A35%5D1%3D%5BO%3A37%5D)(%5BCH3%3A23%5D)%5BCH3%3A24%5D&w=100&h=80)
![[Cl:14][CH2:15][CH2:16][CH2:17][O:13][C:11]([N:21]1[CH2:22][CH2:23][N:18]([C:24](=[O:26])[CH3:25])[CH2:19][CH2:20]1)=[O:12]](/api/mol/svg?smiles=%5BCl%3A14%5D%5BCH2%3A15%5D%5BCH2%3A16%5D%5BCH2%3A17%5D%5BO%3A13%5D%5BC%3A11%5D(%5BN%3A21%5D1%5BCH2%3A22%5D%5BCH2%3A23%5D%5BN%3A18%5D(%5BC%3A24%5D(%3D%5BO%3A26%5D)%5BCH3%3A25%5D)%5BCH2%3A19%5D%5BCH2%3A20%5D1)%3D%5BO%3A12%5D&w=100&h=80)
[NH:21][CH:22]2[CH2:27][CH2:26][N:25]([CH2:28][C:29]3[CH:34]=[CH:33][CH:32]=[CH:31][CH:30]=3)[CH2:24][CH2:23]2)[CH2:16][C:15]2[C:10](=[CH:11][CH:12]=[CH:13][CH:14]=2)[CH2:9]1)=[O:7])([CH3:4])([CH3:3])[CH3:1]](/api/mol/svg?smiles=%5BC%3A2%5D(%5BO%3A5%5D%5BC%3A6%5D(%5BN%3A8%5D1%5BC%40H%3A17%5D(%5BC%3A18%5D(%3D%5BO%3A20%5D)%5BNH%3A21%5D%5BCH%3A22%5D2%5BCH2%3A27%5D%5BCH2%3A26%5D%5BN%3A25%5D(%5BCH2%3A28%5D%5BC%3A29%5D3%5BCH%3A34%5D%3D%5BCH%3A33%5D%5BCH%3A32%5D%3D%5BCH%3A31%5D%5BCH%3A30%5D%3D3)%5BCH2%3A24%5D%5BCH2%3A23%5D2)%5BCH2%3A16%5D%5BC%3A15%5D2%5BC%3A10%5D(%3D%5BCH%3A11%5D%5BCH%3A12%5D%3D%5BCH%3A13%5D%5BCH%3A14%5D%3D2)%5BCH2%3A9%5D1)%3D%5BO%3A7%5D)(%5BCH3%3A4%5D)(%5BCH3%3A3%5D)%5BCH3%3A1%5D&w=100&h=80)
[N:43]([CH2:36][C:37]2[CH:42]=[CH:41][CH:40]=[CH:39][CH:38]=2)[CH2:44][CH2:45][N:46]([CH3:48])[CH3:47])[CH2:16][C:15]2[C:10](=[CH:11][CH:12]=[CH:13][CH:14]=2)[CH2:9]1)=[O:7])([CH3:4])([CH3:3])[CH3:1]](/api/mol/svg?smiles=%5BC%3A2%5D(%5BO%3A5%5D%5BC%3A6%5D(%5BN%3A8%5D1%5BCH%3A17%5D(%5BC%3A18%5D(%3D%5BO%3A20%5D)%5BN%3A43%5D(%5BCH2%3A36%5D%5BC%3A37%5D2%5BCH%3A42%5D%3D%5BCH%3A41%5D%5BCH%3A40%5D%3D%5BCH%3A39%5D%5BCH%3A38%5D%3D2)%5BCH2%3A44%5D%5BCH2%3A45%5D%5BN%3A46%5D(%5BCH3%3A48%5D)%5BCH3%3A47%5D)%5BCH2%3A16%5D%5BC%3A15%5D2%5BC%3A10%5D(%3D%5BCH%3A11%5D%5BCH%3A12%5D%3D%5BCH%3A13%5D%5BCH%3A14%5D%3D2)%5BCH2%3A9%5D1)%3D%5BO%3A7%5D)(%5BCH3%3A4%5D)(%5BCH3%3A3%5D)%5BCH3%3A1%5D&w=100&h=80)
![[NH2:7][C@@H:8]([C:9]([CH3:12])([CH3:11])[CH3:10])[C:13]([NH:14][C@@H:15]1[CH2:19][CH2:18][N:17]([CH2:20][C:21]2[CH:26]=[CH:25][CH:24]=[CH:23][CH:22]=2)[CH2:16]1)=[O:27]](/api/mol/svg?smiles=%5BNH2%3A7%5D%5BC%40%40H%3A8%5D(%5BC%3A9%5D(%5BCH3%3A12%5D)(%5BCH3%3A11%5D)%5BCH3%3A10%5D)%5BC%3A13%5D(%5BNH%3A14%5D%5BC%40%40H%3A15%5D1%5BCH2%3A19%5D%5BCH2%3A18%5D%5BN%3A17%5D(%5BCH2%3A20%5D%5BC%3A21%5D2%5BCH%3A26%5D%3D%5BCH%3A25%5D%5BCH%3A24%5D%3D%5BCH%3A23%5D%5BCH%3A22%5D%3D2)%5BCH2%3A16%5D1)%3D%5BO%3A27%5D&w=100&h=80)
[C@@H:15]([NH:14][C:10]([NH:9][C:5]2[CH:6]=[CH:7][CH:8]=[C:3]([C:2]([F:12])([F:13])[F:1])[CH:4]=2)=[O:11])[C:31]([CH3:32])([CH3:34])[CH3:33])[CH2:20]1)[C:25]1[CH:26]=[CH:27][CH:28]=[CH:29][CH:30]=1](/api/mol/svg?smiles=%5BCH2%3A24%5D(%5BN%3A21%5D1%5BCH2%3A22%5D%5BCH2%3A23%5D%5BC%40%40H%3A19%5D(%5BNH%3A18%5D%5BC%3A16%5D(%3D%5BO%3A17%5D)%5BC%40%40H%3A15%5D(%5BNH%3A14%5D%5BC%3A10%5D(%5BNH%3A9%5D%5BC%3A5%5D2%5BCH%3A6%5D%3D%5BCH%3A7%5D%5BCH%3A8%5D%3D%5BC%3A3%5D(%5BC%3A2%5D(%5BF%3A12%5D)(%5BF%3A13%5D)%5BF%3A1%5D)%5BCH%3A4%5D%3D2)%3D%5BO%3A11%5D)%5BC%3A31%5D(%5BCH3%3A32%5D)(%5BCH3%3A34%5D)%5BCH3%3A33%5D)%5BCH2%3A20%5D1)%5BC%3A25%5D1%5BCH%3A26%5D%3D%5BCH%3A27%5D%5BCH%3A28%5D%3D%5BCH%3A29%5D%5BCH%3A30%5D%3D1&w=100&h=80)
Dataset #62
反应 #355772
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355773
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355774
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355775
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355776
收率 43.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #355777
收率 74.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #355778
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355779
收率 31.1%DOI: 10.6084/m9.figshare.5104873.v1
反应 #355780
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355781
收率 99.3%DOI: 10.6084/m9.figshare.5104873.v1
反应 #355782
收率 43.7%DOI: 10.6084/m9.figshare.5104873.v1
反应 #355783
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355784
收率 90.6%DOI: 10.6084/m9.figshare.5104873.v1
反应 #355785
收率 98.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #355786
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355787
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355788
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355789
收率 26.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #355790
DOI: 10.6084/m9.figshare.5104873.v1
反应 #355791
收率 34.0%DOI: 10.6084/m9.figshare.5104873.v1