← 浏览数据集![[ClH:40]](/api/mol/svg?smiles=%5BClH%3A40%5D&w=100&h=80)
[C:11](=[O:21])[CH:12]=[C:13]([C:15]2[CH:20]=[CH:19][N:18]=[CH:17][N:16]=2)[N:14]=1)=[O:29])([CH3:26])([CH3:24])[CH3:25]](/api/mol/svg?smiles=%5BC%3A23%5D(%5BO%3A27%5D%5BC%3A28%5D(%5BN%3A30%5D1%5BCH2%3A35%5D%5BCH%3A34%5D2%5BCH2%3A36%5D%5BC%40H%3A31%5D1%5BCH2%3A32%5D%5BN%3A33%5D2%5BC%3A9%5D1%5BN%3A10%5D(%5BCH3%3A22%5D)%5BC%3A11%5D(%3D%5BO%3A21%5D)%5BCH%3A12%5D%3D%5BC%3A13%5D(%5BC%3A15%5D2%5BCH%3A20%5D%3D%5BCH%3A19%5D%5BN%3A18%5D%3D%5BCH%3A17%5D%5BN%3A16%5D%3D2)%5BN%3A14%5D%3D1)%3D%5BO%3A29%5D)(%5BCH3%3A26%5D)(%5BCH3%3A24%5D)%5BCH3%3A25%5D&w=100&h=80)
[C:14](=[O:17])[CH:13]=[C:12]([C:18]2[CH:23]=[CH:22][N:21]=[CH:20][CH:19]=2)[N:11]=1)=[O:30])([CH3:27])([CH3:25])[CH3:26]](/api/mol/svg?smiles=%5BC%3A24%5D(%5BO%3A28%5D%5BC%3A29%5D(%5BN%3A31%5D1%5BCH2%3A36%5D%5BCH%3A35%5D2%5BCH2%3A37%5D%5BC%40H%3A32%5D1%5BCH2%3A33%5D%5BN%3A34%5D2%5BC%3A10%5D1%5BN%3A15%5D(%5BCH3%3A16%5D)%5BC%3A14%5D(%3D%5BO%3A17%5D)%5BCH%3A13%5D%3D%5BC%3A12%5D(%5BC%3A18%5D2%5BCH%3A23%5D%3D%5BCH%3A22%5D%5BN%3A21%5D%3D%5BCH%3A20%5D%5BCH%3A19%5D%3D2)%5BN%3A11%5D%3D1)%3D%5BO%3A30%5D)(%5BCH3%3A27%5D)(%5BCH3%3A25%5D)%5BCH3%3A26%5D&w=100&h=80)
![[CH3:14][N:13]1[C:12](=[O:15])[CH:11]=[C:10]([C:16]2[CH:21]=[CH:20][N:19]=[CH:18][CH:17]=2)[N:9]=[C:8]1[N:2]1[CH2:3][CH:4]2[CH2:7][C@H:1]1[CH2:6][N:5]2[C:23]1[CH:24]=[N:25][CH:26]=[CH:27][CH:28]=1](/api/mol/svg?smiles=%5BCH3%3A14%5D%5BN%3A13%5D1%5BC%3A12%5D(%3D%5BO%3A15%5D)%5BCH%3A11%5D%3D%5BC%3A10%5D(%5BC%3A16%5D2%5BCH%3A21%5D%3D%5BCH%3A20%5D%5BN%3A19%5D%3D%5BCH%3A18%5D%5BCH%3A17%5D%3D2)%5BN%3A9%5D%3D%5BC%3A8%5D1%5BN%3A2%5D1%5BCH2%3A3%5D%5BCH%3A4%5D2%5BCH2%3A7%5D%5BC%40H%3A1%5D1%5BCH2%3A6%5D%5BN%3A5%5D2%5BC%3A23%5D1%5BCH%3A24%5D%3D%5BN%3A25%5D%5BCH%3A26%5D%3D%5BCH%3A27%5D%5BCH%3A28%5D%3D1&w=100&h=80)
![[OH:4][C@H:5]1[C@:18]23[CH2:19][CH2:20][C@@H:7]([CH2:8][C@H:9]2[C@@:10]2([CH3:25])[C@H:15]([CH2:16][CH2:17]3)[C@:14]([CH3:24])([C:21]([OH:23])=[O:22])[CH2:13][CH2:12][CH2:11]2)[C@@H:6]1[S:26]([CH3:28])=[O:27]](/api/mol/svg?smiles=%5BOH%3A4%5D%5BC%40H%3A5%5D1%5BC%40%3A18%5D23%5BCH2%3A19%5D%5BCH2%3A20%5D%5BC%40%40H%3A7%5D(%5BCH2%3A8%5D%5BC%40H%3A9%5D2%5BC%40%40%3A10%5D2(%5BCH3%3A25%5D)%5BC%40H%3A15%5D(%5BCH2%3A16%5D%5BCH2%3A17%5D3)%5BC%40%3A14%5D(%5BCH3%3A24%5D)(%5BC%3A21%5D(%5BOH%3A23%5D)%3D%5BO%3A22%5D)%5BCH2%3A13%5D%5BCH2%3A12%5D%5BCH2%3A11%5D2)%5BC%40%40H%3A6%5D1%5BS%3A26%5D(%5BCH3%3A28%5D)%3D%5BO%3A27%5D&w=100&h=80)
![[CH3:17][CH:5]([C:6]([NH:8][CH2:9][C:10]([F:15])([F:16])[C:11]([F:12])([F:14])[F:13])=[O:7])[C:4]([OH:18])=[O:3]](/api/mol/svg?smiles=%5BCH3%3A17%5D%5BCH%3A5%5D(%5BC%3A6%5D(%5BNH%3A8%5D%5BCH2%3A9%5D%5BC%3A10%5D(%5BF%3A15%5D)(%5BF%3A16%5D)%5BC%3A11%5D(%5BF%3A12%5D)(%5BF%3A14%5D)%5BF%3A13%5D)%3D%5BO%3A7%5D)%5BC%3A4%5D(%5BOH%3A18%5D)%3D%5BO%3A3%5D&w=100&h=80)
![[CH3:14][CH:15]([C:19]([NH:21][CH2:22][C:23]([F:28])([F:29])[C:24]([F:25])([F:27])[F:26])=[O:20])[C:16]([NH:1][C@@H:2]1[C:8](=[O:9])[NH:7][C:6]2[CH:10]=[CH:11][CH:12]=[CH:13][C:5]=2[O:4][CH2:3]1)=[O:17]](/api/mol/svg?smiles=%5BCH3%3A14%5D%5BCH%3A15%5D(%5BC%3A19%5D(%5BNH%3A21%5D%5BCH2%3A22%5D%5BC%3A23%5D(%5BF%3A28%5D)(%5BF%3A29%5D)%5BC%3A24%5D(%5BF%3A25%5D)(%5BF%3A27%5D)%5BF%3A26%5D)%3D%5BO%3A20%5D)%5BC%3A16%5D(%5BNH%3A1%5D%5BC%40%40H%3A2%5D1%5BC%3A8%5D(%3D%5BO%3A9%5D)%5BNH%3A7%5D%5BC%3A6%5D2%5BCH%3A10%5D%3D%5BCH%3A11%5D%5BCH%3A12%5D%3D%5BCH%3A13%5D%5BC%3A5%5D%3D2%5BO%3A4%5D%5BCH2%3A3%5D1)%3D%5BO%3A17%5D&w=100&h=80)
![[CH3:10][N:7]1[C:6]2[CH:11]=[CH:12][CH:13]=[CH:14][C:5]=2[O:4][CH2:3][C@H:2]([NH:1][C:21](=[O:22])[CH2:20][C:19]([NH:18][CH2:17][C:16]([F:29])([F:15])[C:25]([F:26])([F:28])[F:27])=[O:24])[C:8]1=[O:9]](/api/mol/svg?smiles=%5BCH3%3A10%5D%5BN%3A7%5D1%5BC%3A6%5D2%5BCH%3A11%5D%3D%5BCH%3A12%5D%5BCH%3A13%5D%3D%5BCH%3A14%5D%5BC%3A5%5D%3D2%5BO%3A4%5D%5BCH2%3A3%5D%5BC%40H%3A2%5D(%5BNH%3A1%5D%5BC%3A21%5D(%3D%5BO%3A22%5D)%5BCH2%3A20%5D%5BC%3A19%5D(%5BNH%3A18%5D%5BCH2%3A17%5D%5BC%3A16%5D(%5BF%3A29%5D)(%5BF%3A15%5D)%5BC%3A25%5D(%5BF%3A26%5D)(%5BF%3A28%5D)%5BF%3A27%5D)%3D%5BO%3A24%5D)%5BC%3A8%5D1%3D%5BO%3A9%5D&w=100&h=80)
=[CH:20][C:19]=1[N+:25]([O-:27])=[O:26])[C:10]([OH:12])=[O:11])=[O:7])([CH3:4])([CH3:3])[CH3:2]](/api/mol/svg?smiles=%5BC%3A1%5D(%5BO%3A5%5D%5BC%3A6%5D(%5BNH%3A8%5D%5BC%40%40H%3A9%5D(%5BCH2%3A13%5D%5BO%3A14%5D%5BC%3A18%5D1%5BCH%3A23%5D%3D%5BCH%3A22%5D%5BC%3A21%5D(%5BF%3A24%5D)%3D%5BCH%3A20%5D%5BC%3A19%5D%3D1%5BN%2B%3A25%5D(%5BO-%3A27%5D)%3D%5BO%3A26%5D)%5BC%3A10%5D(%5BOH%3A12%5D)%3D%5BO%3A11%5D)%3D%5BO%3A7%5D)(%5BCH3%3A4%5D)(%5BCH3%3A3%5D)%5BCH3%3A2%5D&w=100&h=80)
![[NH2:22][C:16]1[CH:17]=[C:18]([F:21])[CH:19]=[CH:20][C:15]=1[O:14][CH2:13][C@H:9]([NH:8][C:6]([O:5][C:1]([CH3:4])([CH3:2])[CH3:3])=[O:7])[C:10]([OH:12])=[O:11]](/api/mol/svg?smiles=%5BNH2%3A22%5D%5BC%3A16%5D1%5BCH%3A17%5D%3D%5BC%3A18%5D(%5BF%3A21%5D)%5BCH%3A19%5D%3D%5BCH%3A20%5D%5BC%3A15%5D%3D1%5BO%3A14%5D%5BCH2%3A13%5D%5BC%40H%3A9%5D(%5BNH%3A8%5D%5BC%3A6%5D(%5BO%3A5%5D%5BC%3A1%5D(%5BCH3%3A4%5D)(%5BCH3%3A2%5D)%5BCH3%3A3%5D)%3D%5BO%3A7%5D)%5BC%3A10%5D(%5BOH%3A12%5D)%3D%5BO%3A11%5D&w=100&h=80)
[NH:10][C@@H:6]1[C:7](=[O:8])[NH:1][C:2]2[CH:21]=[C:20]([F:22])[CH:19]=[CH:18][C:3]=2[O:4][CH2:5]1)([CH3:17])([CH3:16])[CH3:15]](/api/mol/svg?smiles=%5BC%3A14%5D(%5BO%3A13%5D%5BC%3A11%5D(%3D%5BO%3A12%5D)%5BNH%3A10%5D%5BC%40%40H%3A6%5D1%5BC%3A7%5D(%3D%5BO%3A8%5D)%5BNH%3A1%5D%5BC%3A2%5D2%5BCH%3A21%5D%3D%5BC%3A20%5D(%5BF%3A22%5D)%5BCH%3A19%5D%3D%5BCH%3A18%5D%5BC%3A3%5D%3D2%5BO%3A4%5D%5BCH2%3A5%5D1)(%5BCH3%3A17%5D)(%5BCH3%3A16%5D)%5BCH3%3A15%5D&w=100&h=80)
[NH:7][C@@H:8]1[C:14](=[O:15])[N:13]([CH3:22])[C:12]2[CH:16]=[C:17]([F:20])[CH:18]=[CH:19][C:11]=2[O:10][CH2:9]1)([CH3:4])([CH3:2])[CH3:3]](/api/mol/svg?smiles=%5BC%3A1%5D(%5BO%3A5%5D%5BC%3A6%5D(%3D%5BO%3A21%5D)%5BNH%3A7%5D%5BC%40%40H%3A8%5D1%5BC%3A14%5D(%3D%5BO%3A15%5D)%5BN%3A13%5D(%5BCH3%3A22%5D)%5BC%3A12%5D2%5BCH%3A16%5D%3D%5BC%3A17%5D(%5BF%3A20%5D)%5BCH%3A18%5D%3D%5BCH%3A19%5D%5BC%3A11%5D%3D2%5BO%3A10%5D%5BCH2%3A9%5D1)(%5BCH3%3A4%5D)(%5BCH3%3A2%5D)%5BCH3%3A3%5D&w=100&h=80)
![[NH2:7][C@@H:8]1[C:14](=[O:15])[N:13]([CH3:16])[C:12]2[CH:17]=[C:18]([F:21])[CH:19]=[CH:20][C:11]=2[O:10][CH2:9]1](/api/mol/svg?smiles=%5BNH2%3A7%5D%5BC%40%40H%3A8%5D1%5BC%3A14%5D(%3D%5BO%3A15%5D)%5BN%3A13%5D(%5BCH3%3A16%5D)%5BC%3A12%5D2%5BCH%3A17%5D%3D%5BC%3A18%5D(%5BF%3A21%5D)%5BCH%3A19%5D%3D%5BCH%3A20%5D%5BC%3A11%5D%3D2%5BO%3A10%5D%5BCH2%3A9%5D1&w=100&h=80)
[C@@H:52]([NH:55][C:56]([O:58][C:59]([CH3:62])([CH3:61])[CH3:60])=[O:57])[CH2:53][O:42][C:34]1[C:35]([N+:39]([O-:41])=[O:40])=[CH:36][CH:37]=[CH:38][C:33]=1[Cl:32])[C:44]1[CH:45]=[CH:46][CH:47]=[CH:48][CH:49]=1](/api/mol/svg?smiles=%5BCH2%3A43%5D(%5BO%3A50%5D%5BC%3A51%5D(%3D%5BO%3A63%5D)%5BC%40%40H%3A52%5D(%5BNH%3A55%5D%5BC%3A56%5D(%5BO%3A58%5D%5BC%3A59%5D(%5BCH3%3A62%5D)(%5BCH3%3A61%5D)%5BCH3%3A60%5D)%3D%5BO%3A57%5D)%5BCH2%3A53%5D%5BO%3A42%5D%5BC%3A34%5D1%5BC%3A35%5D(%5BN%2B%3A39%5D(%5BO-%3A41%5D)%3D%5BO%3A40%5D)%3D%5BCH%3A36%5D%5BCH%3A37%5D%3D%5BCH%3A38%5D%5BC%3A33%5D%3D1%5BCl%3A32%5D)%5BC%3A44%5D1%5BCH%3A45%5D%3D%5BCH%3A46%5D%5BCH%3A47%5D%3D%5BCH%3A48%5D%5BCH%3A49%5D%3D1&w=100&h=80)
![[NH2:19][C:18]1[CH:17]=[CH:16][CH:15]=[C:14]([Cl:22])[C:13]=1[O:12][CH2:11][C@H:10]([NH:23][C:24]([O:26][C:27]([CH3:30])([CH3:28])[CH3:29])=[O:25])[C:9]([OH:31])=[O:8]](/api/mol/svg?smiles=%5BNH2%3A19%5D%5BC%3A18%5D1%5BCH%3A17%5D%3D%5BCH%3A16%5D%5BCH%3A15%5D%3D%5BC%3A14%5D(%5BCl%3A22%5D)%5BC%3A13%5D%3D1%5BO%3A12%5D%5BCH2%3A11%5D%5BC%40H%3A10%5D(%5BNH%3A23%5D%5BC%3A24%5D(%5BO%3A26%5D%5BC%3A27%5D(%5BCH3%3A30%5D)(%5BCH3%3A28%5D)%5BCH3%3A29%5D)%3D%5BO%3A25%5D)%5BC%3A9%5D(%5BOH%3A31%5D)%3D%5BO%3A8%5D&w=100&h=80)
![[Cl:15][C:14]1[C:5]2[O:4][CH2:3][C@H:2]([NH:1][C:18](=[O:19])[CH:17]([CH3:16])[C:21]([NH:23][CH2:24][C:25]([F:30])([F:31])[C:26]([F:27])([F:28])[F:29])=[O:22])[C:8](=[O:9])[N:7]([CH3:10])[C:6]=2[CH:11]=[CH:12][CH:13]=1](/api/mol/svg?smiles=%5BCl%3A15%5D%5BC%3A14%5D1%5BC%3A5%5D2%5BO%3A4%5D%5BCH2%3A3%5D%5BC%40H%3A2%5D(%5BNH%3A1%5D%5BC%3A18%5D(%3D%5BO%3A19%5D)%5BCH%3A17%5D(%5BCH3%3A16%5D)%5BC%3A21%5D(%5BNH%3A23%5D%5BCH2%3A24%5D%5BC%3A25%5D(%5BF%3A30%5D)(%5BF%3A31%5D)%5BC%3A26%5D(%5BF%3A27%5D)(%5BF%3A28%5D)%5BF%3A29%5D)%3D%5BO%3A22%5D)%5BC%3A8%5D(%3D%5BO%3A9%5D)%5BN%3A7%5D(%5BCH3%3A10%5D)%5BC%3A6%5D%3D2%5BCH%3A11%5D%3D%5BCH%3A12%5D%5BCH%3A13%5D%3D1&w=100&h=80)
=[O:30])[CH2:20][O:21][S:6]1(=[O:7])=[O:32])=[O:24])([CH3:27])([CH3:29])[CH3:28]](/api/mol/svg?smiles=%5BC%3A26%5D(%5BO%3A25%5D%5BC%3A23%5D(%5BN%3A22%5D1%5BC%40H%3A19%5D(%5BC%3A18%5D(%5BO%3A17%5D%5BCH2%3A10%5D%5BC%3A11%5D2%5BCH%3A16%5D%3D%5BCH%3A15%5D%5BCH%3A14%5D%3D%5BCH%3A13%5D%5BCH%3A12%5D%3D2)%3D%5BO%3A30%5D)%5BCH2%3A20%5D%5BO%3A21%5D%5BS%3A6%5D1(%3D%5BO%3A7%5D)%3D%5BO%3A32%5D)%3D%5BO%3A24%5D)(%5BCH3%3A27%5D)(%5BCH3%3A29%5D)%5BCH3%3A28%5D&w=100&h=80)
[C@@H:25]([NH:21][C:19]([O:18][C:14]([CH3:17])([CH3:16])[CH3:15])=[O:20])[CH2:24][O:11][C:3]1[C:4]([N+:8]([O-:10])=[O:9])=[CH:5][CH:6]=[CH:7][C:2]=1[CH3:1])[C:30]1[CH:31]=[CH:32][CH:33]=[CH:34][CH:35]=1](/api/mol/svg?smiles=%5BCH2%3A29%5D(%5BO%3A28%5D%5BC%3A26%5D(%3D%5BO%3A27%5D)%5BC%40%40H%3A25%5D(%5BNH%3A21%5D%5BC%3A19%5D(%5BO%3A18%5D%5BC%3A14%5D(%5BCH3%3A17%5D)(%5BCH3%3A16%5D)%5BCH3%3A15%5D)%3D%5BO%3A20%5D)%5BCH2%3A24%5D%5BO%3A11%5D%5BC%3A3%5D1%5BC%3A4%5D(%5BN%2B%3A8%5D(%5BO-%3A10%5D)%3D%5BO%3A9%5D)%3D%5BCH%3A5%5D%5BCH%3A6%5D%3D%5BCH%3A7%5D%5BC%3A2%5D%3D1%5BCH3%3A1%5D)%5BC%3A30%5D1%5BCH%3A31%5D%3D%5BCH%3A32%5D%5BCH%3A33%5D%3D%5BCH%3A34%5D%5BCH%3A35%5D%3D1&w=100&h=80)
[NH:10][C@@H:11]1[C:17](=[O:18])[N:16]([CH2:2][CH3:3])[C:15]2[CH:19]=[CH:20][CH:21]=[CH:22][C:14]=2[O:13][CH2:12]1)([CH3:7])([CH3:5])[CH3:6]](/api/mol/svg?smiles=%5BC%3A4%5D(%5BO%3A8%5D%5BC%3A9%5D(%3D%5BO%3A23%5D)%5BNH%3A10%5D%5BC%40%40H%3A11%5D1%5BC%3A17%5D(%3D%5BO%3A18%5D)%5BN%3A16%5D(%5BCH2%3A2%5D%5BCH3%3A3%5D)%5BC%3A15%5D2%5BCH%3A19%5D%3D%5BCH%3A20%5D%5BCH%3A21%5D%3D%5BCH%3A22%5D%5BC%3A14%5D%3D2%5BO%3A13%5D%5BCH2%3A12%5D1)(%5BCH3%3A7%5D)(%5BCH3%3A5%5D)%5BCH3%3A6%5D&w=100&h=80)
![[CH3:3][O:4][C:5](=[O:17])[CH:6]([CH2:11][CH:12]1[O:16][CH2:15][CH2:14][O:13]1)[C:7]([OH:9])=[O:8]](/api/mol/svg?smiles=%5BCH3%3A3%5D%5BO%3A4%5D%5BC%3A5%5D(%3D%5BO%3A17%5D)%5BCH%3A6%5D(%5BCH2%3A11%5D%5BCH%3A12%5D1%5BO%3A16%5D%5BCH2%3A15%5D%5BCH2%3A14%5D%5BO%3A13%5D1)%5BC%3A7%5D(%5BOH%3A9%5D)%3D%5BO%3A8%5D&w=100&h=80)
Dataset #301
反应 #1435758
收率 72.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435759
收率 99.3%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435760
收率 72.1%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435761
收率 46.5%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435762
DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435763
DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435764
收率 39.6%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435765
收率 39.4%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435766
收率 52.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435767
收率 52.4%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435768
收率 86.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435769
收率 51.3%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435770
收率 90.3%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435771
收率 50.9%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435772
收率 91.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435773
DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435774
收率 66.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435775
收率 33.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435776
DOI: 10.6084/m9.figshare.5104873.v1
反应 #1435777
收率 57.4%DOI: 10.6084/m9.figshare.5104873.v1