← 浏览数据集[CH2:22]1)[C:8]1[CH:9]=[CH:10][CH:11]=[CH:12][CH:13]=1](/api/mol/svg?smiles=%5BCH2%3A7%5D(%5BN%3A14%5D1%5BCH2%3A15%5D%5BCH2%3A16%5D%5BCH2%3A17%5D%5BCH2%3A18%5D%5BC%3A19%5D(%3D%5BO%3A21%5D)%5BCH2%3A22%5D1)%5BC%3A8%5D1%5BCH%3A9%5D%3D%5BCH%3A10%5D%5BCH%3A11%5D%3D%5BCH%3A12%5D%5BCH%3A13%5D%3D1&w=100&h=80)
[C:10](=[O:15])[CH2:9]1)[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BN%3A8%5D1%5BCH2%3A14%5D%5BCH2%3A13%5D%5BCH2%3A12%5D%5BCH%3A11%5D(%5BBr%3A16%5D)%5BC%3A10%5D(%3D%5BO%3A15%5D)%5BCH2%3A9%5D1)%5BC%3A2%5D1%5BCH%3A3%5D%3D%5BCH%3A4%5D%5BCH%3A5%5D%3D%5BCH%3A6%5D%5BCH%3A7%5D%3D1&w=100&h=80)
=[NH:30])=[N:19][C:27]=2[CH2:26][CH2:25][NH:24]1)(=[O:15])[CH2:11][CH2:12][CH2:13][CH3:14]](/api/mol/svg?smiles=%5BC%3A10%5D(%5BCH%3A23%5D1%5BC%3A22%5D2%5BS%3A21%5D%5BC%3A20%5D(%5BNH%3A28%5D%5BC%3A29%5D(%5BNH2%3A31%5D)%3D%5BNH%3A30%5D)%3D%5BN%3A19%5D%5BC%3A27%5D%3D2%5BCH2%3A26%5D%5BCH2%3A25%5D%5BNH%3A24%5D1)(%3D%5BO%3A15%5D)%5BCH2%3A11%5D%5BCH2%3A12%5D%5BCH2%3A13%5D%5BCH3%3A14%5D&w=100&h=80)
=[NH:56])[S:47][C:48]=2[CH2:49]1)(=[O:15])[CH2:12][CH:10]=[CH2:11]](/api/mol/svg?smiles=%5BC%3A13%5D(%5BN%3A50%5D1%5BCH2%3A51%5D%5BCH2%3A52%5D%5BC%3A53%5D2%5BN%3A45%5D%3D%5BC%3A46%5D(%5BNH%3A54%5D%5BC%3A55%5D(%5BNH2%3A57%5D)%3D%5BNH%3A56%5D)%5BS%3A47%5D%5BC%3A48%5D%3D2%5BCH2%3A49%5D1)(%3D%5BO%3A15%5D)%5BCH2%3A12%5D%5BCH%3A10%5D%3D%5BCH2%3A11%5D&w=100&h=80)
=[NH:23])[S:14][C:15]=2[CH2:16]1)=[O:3])[C:6]1[CH:11]=[CH:10][CH:9]=[CH:8][CH:7]=1](/api/mol/svg?smiles=%5BCH2%3A5%5D(%5BO%3A4%5D%5BC%3A2%5D(%5BN%3A17%5D1%5BCH2%3A18%5D%5BCH2%3A19%5D%5BC%3A20%5D2%5BN%3A12%5D%3D%5BC%3A13%5D(%5BNH%3A21%5D%5BC%3A22%5D(%5BNH2%3A24%5D)%3D%5BNH%3A23%5D)%5BS%3A14%5D%5BC%3A15%5D%3D2%5BCH2%3A16%5D1)%3D%5BO%3A3%5D)%5BC%3A6%5D1%5BCH%3A11%5D%3D%5BCH%3A10%5D%5BCH%3A9%5D%3D%5BCH%3A8%5D%5BCH%3A7%5D%3D1&w=100&h=80)
![[C:10]1([NH:16][C:17]([N:26]2[CH2:27][CH2:28][C:29]3[N:21]=[C:22]([NH:30][C:31]([NH2:33])=[NH:32])[S:23][C:24]=3[CH2:25]2)=[O:18])[CH:15]=[CH:14][CH:13]=[CH:12][CH:11]=1](/api/mol/svg?smiles=%5BC%3A10%5D1(%5BNH%3A16%5D%5BC%3A17%5D(%5BN%3A26%5D2%5BCH2%3A27%5D%5BCH2%3A28%5D%5BC%3A29%5D3%5BN%3A21%5D%3D%5BC%3A22%5D(%5BNH%3A30%5D%5BC%3A31%5D(%5BNH2%3A33%5D)%3D%5BNH%3A32%5D)%5BS%3A23%5D%5BC%3A24%5D%3D3%5BCH2%3A25%5D2)%3D%5BO%3A18%5D)%5BCH%3A15%5D%3D%5BCH%3A14%5D%5BCH%3A13%5D%3D%5BCH%3A12%5D%5BCH%3A11%5D%3D1&w=100&h=80)
![[NH2:13][C:10]1[CH:11]=[C:12]2[C:7](=[CH:8][CH:9]=1)[N:6]=[C:5]([O:16][CH:22]([CH3:24])[CH3:23])[CH:4]=[C:3]2[C:2]([F:18])([F:17])[F:1]](/api/mol/svg?smiles=%5BNH2%3A13%5D%5BC%3A10%5D1%5BCH%3A11%5D%3D%5BC%3A12%5D2%5BC%3A7%5D(%3D%5BCH%3A8%5D%5BCH%3A9%5D%3D1)%5BN%3A6%5D%3D%5BC%3A5%5D(%5BO%3A16%5D%5BCH%3A22%5D(%5BCH3%3A24%5D)%5BCH3%3A23%5D)%5BCH%3A4%5D%3D%5BC%3A3%5D2%5BC%3A2%5D(%5BF%3A18%5D)(%5BF%3A17%5D)%5BF%3A1%5D&w=100&h=80)
[NH:8][C:7](=[O:12])[CH:6]=[C:5]2[C:13]([F:16])([F:14])[F:15])[NH2:17]](/api/mol/svg?smiles=%5BNH%3A1%5D(%5BC%3A2%5D1%5BCH%3A3%5D%3D%5BC%3A4%5D2%5BC%3A9%5D(%3D%5BCH%3A10%5D%5BCH%3A11%5D%3D1)%5BNH%3A8%5D%5BC%3A7%5D(%3D%5BO%3A12%5D)%5BCH%3A6%5D%3D%5BC%3A5%5D2%5BC%3A13%5D(%5BF%3A16%5D)(%5BF%3A14%5D)%5BF%3A15%5D)%5BNH2%3A17%5D&w=100&h=80)
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![[F:24][C:2]([F:1])([F:23])[C:3]1[C:16]2[C:7](=[CH:8][C:9]3[CH2:10][CH2:11][CH:12]([CH3:21])[N:13]([CH2:17][CH3:18])[C:14]=3[CH:15]=2)[NH:6][C:5](=[O:22])[CH:4]=1](/api/mol/svg?smiles=%5BF%3A24%5D%5BC%3A2%5D(%5BF%3A1%5D)(%5BF%3A23%5D)%5BC%3A3%5D1%5BC%3A16%5D2%5BC%3A7%5D(%3D%5BCH%3A8%5D%5BC%3A9%5D3%5BCH2%3A10%5D%5BCH2%3A11%5D%5BCH%3A12%5D(%5BCH3%3A21%5D)%5BN%3A13%5D(%5BCH2%3A17%5D%5BCH3%3A18%5D)%5BC%3A14%5D%3D3%5BCH%3A15%5D%3D2)%5BNH%3A6%5D%5BC%3A5%5D(%3D%5BO%3A22%5D)%5BCH%3A4%5D%3D1&w=100&h=80)
![[F:22][C:2]([F:1])([F:21])[C:3]1[C:16]2[C:7](=[CH:8][C:9]3[CH2:10][CH2:11][CH:12]([CH3:19])[N:13]([CH2:26][C:27]([F:28])([F:29])[F:30])[C:14]=3[CH:15]=2)[NH:6][C:5](=[O:20])[CH:4]=1](/api/mol/svg?smiles=%5BF%3A22%5D%5BC%3A2%5D(%5BF%3A1%5D)(%5BF%3A21%5D)%5BC%3A3%5D1%5BC%3A16%5D2%5BC%3A7%5D(%3D%5BCH%3A8%5D%5BC%3A9%5D3%5BCH2%3A10%5D%5BCH2%3A11%5D%5BCH%3A12%5D(%5BCH3%3A19%5D)%5BN%3A13%5D(%5BCH2%3A26%5D%5BC%3A27%5D(%5BF%3A28%5D)(%5BF%3A29%5D)%5BF%3A30%5D)%5BC%3A14%5D%3D3%5BCH%3A15%5D%3D2)%5BNH%3A6%5D%5BC%3A5%5D(%3D%5BO%3A20%5D)%5BCH%3A4%5D%3D1&w=100&h=80)
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![[F:1][C:2]([F:24])([F:23])[C:3]1[C:16]2[C:7](=[CH:8][C:9]3[CH2:10][CH2:11][CH2:12][N:13]([CH2:17][CH2:18][CH3:25])[C:14]=3[CH:15]=2)[NH:6][C:5](=[O:22])[CH:4]=1](/api/mol/svg?smiles=%5BF%3A1%5D%5BC%3A2%5D(%5BF%3A24%5D)(%5BF%3A23%5D)%5BC%3A3%5D1%5BC%3A16%5D2%5BC%3A7%5D(%3D%5BCH%3A8%5D%5BC%3A9%5D3%5BCH2%3A10%5D%5BCH2%3A11%5D%5BCH2%3A12%5D%5BN%3A13%5D(%5BCH2%3A17%5D%5BCH2%3A18%5D%5BCH3%3A25%5D)%5BC%3A14%5D%3D3%5BCH%3A15%5D%3D2)%5BNH%3A6%5D%5BC%3A5%5D(%3D%5BO%3A22%5D)%5BCH%3A4%5D%3D1&w=100&h=80)
![[F:22][C:2]([F:1])([F:21])[C:3]1[C:16]2[C:7](=[CH:8][C:9]3[CH2:10][CH2:11][CH2:12][N:13]([CH2:17][CH3:18])[C:14]=3[CH:15]=2)[NH:6][C:5](=[O:20])[CH:4]=1](/api/mol/svg?smiles=%5BF%3A22%5D%5BC%3A2%5D(%5BF%3A1%5D)(%5BF%3A21%5D)%5BC%3A3%5D1%5BC%3A16%5D2%5BC%3A7%5D(%3D%5BCH%3A8%5D%5BC%3A9%5D3%5BCH2%3A10%5D%5BCH2%3A11%5D%5BCH2%3A12%5D%5BN%3A13%5D(%5BCH2%3A17%5D%5BCH3%3A18%5D)%5BC%3A14%5D%3D3%5BCH%3A15%5D%3D2)%5BNH%3A6%5D%5BC%3A5%5D(%3D%5BO%3A20%5D)%5BCH%3A4%5D%3D1&w=100&h=80)
![[F:21][C:2]([F:1])([F:20])[C:3]1[C:16]2[C:7](=[CH:8][C:9]3[CH2:10][CH2:11][CH2:12][N:13]([CH2:17][CH:18]4[CH2:23][CH2:22]4)[C:14]=3[CH:15]=2)[NH:6][C:5](=[O:19])[CH:4]=1](/api/mol/svg?smiles=%5BF%3A21%5D%5BC%3A2%5D(%5BF%3A1%5D)(%5BF%3A20%5D)%5BC%3A3%5D1%5BC%3A16%5D2%5BC%3A7%5D(%3D%5BCH%3A8%5D%5BC%3A9%5D3%5BCH2%3A10%5D%5BCH2%3A11%5D%5BCH2%3A12%5D%5BN%3A13%5D(%5BCH2%3A17%5D%5BCH%3A18%5D4%5BCH2%3A23%5D%5BCH2%3A22%5D4)%5BC%3A14%5D%3D3%5BCH%3A15%5D%3D2)%5BNH%3A6%5D%5BC%3A5%5D(%3D%5BO%3A19%5D)%5BCH%3A4%5D%3D1&w=100&h=80)
([CH3:18])[CH3:17])=[O:14])[C@@H:2]([C:10]([NH:33][C@@H:37]([C:38]([O:54][CH2:55][C:24]1[CH:23]=[CH:22][CH:21]=[CH:20][CH:25]=1)=[O:30])[CH2:39][CH:46]([CH3:47])[CH3:45])=[O:12])[CH2:3][C:4]1[CH:5]=[CH:6][CH:7]=[CH:8][CH:9]=1](/api/mol/svg?smiles=%5BNH%3A1%5D(%5BC%3A13%5D(%5BO%3A15%5D%5BC%3A16%5D(%5BCH3%3A19%5D)(%5BCH3%3A18%5D)%5BCH3%3A17%5D)%3D%5BO%3A14%5D)%5BC%40%40H%3A2%5D(%5BC%3A10%5D(%5BNH%3A33%5D%5BC%40%40H%3A37%5D(%5BC%3A38%5D(%5BO%3A54%5D%5BCH2%3A55%5D%5BC%3A24%5D1%5BCH%3A23%5D%3D%5BCH%3A22%5D%5BCH%3A21%5D%3D%5BCH%3A20%5D%5BCH%3A25%5D%3D1)%3D%5BO%3A30%5D)%5BCH2%3A39%5D%5BCH%3A46%5D(%5BCH3%3A47%5D)%5BCH3%3A45%5D)%3D%5BO%3A12%5D)%5BCH2%3A3%5D%5BC%3A4%5D1%5BCH%3A5%5D%3D%5BCH%3A6%5D%5BCH%3A7%5D%3D%5BCH%3A8%5D%5BCH%3A9%5D%3D1&w=100&h=80)
([CH3:43])[CH3:45])=[O:40])[C@@H:2]([C:10]([NH:12][C@@H:13]([C:21]([NH:23][C@@H:24]([C:29]([OH:31])=[O:30])[CH2:25][CH:26]([CH3:28])[CH3:27])=[O:22])[CH2:14][C:15]1[CH:16]=[CH:17][CH:18]=[CH:19][CH:20]=1)=[O:11])[CH2:3][C:4]1[CH:9]=[CH:8][CH:7]=[CH:6][CH:5]=1](/api/mol/svg?smiles=%5BNH%3A1%5D(%5BC%3A39%5D(%5BO%3A41%5D%5BC%3A42%5D(%5BCH3%3A44%5D)(%5BCH3%3A43%5D)%5BCH3%3A45%5D)%3D%5BO%3A40%5D)%5BC%40%40H%3A2%5D(%5BC%3A10%5D(%5BNH%3A12%5D%5BC%40%40H%3A13%5D(%5BC%3A21%5D(%5BNH%3A23%5D%5BC%40%40H%3A24%5D(%5BC%3A29%5D(%5BOH%3A31%5D)%3D%5BO%3A30%5D)%5BCH2%3A25%5D%5BCH%3A26%5D(%5BCH3%3A28%5D)%5BCH3%3A27%5D)%3D%5BO%3A22%5D)%5BCH2%3A14%5D%5BC%3A15%5D1%5BCH%3A16%5D%3D%5BCH%3A17%5D%5BCH%3A18%5D%3D%5BCH%3A19%5D%5BCH%3A20%5D%3D1)%3D%5BO%3A11%5D)%5BCH2%3A3%5D%5BC%3A4%5D1%5BCH%3A9%5D%3D%5BCH%3A8%5D%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BCH%3A5%5D%3D1&w=100&h=80)
![[CH3:23][C:22]1[CH:21]=[C:5]([O:6][C:7]2[CH:12]=[CH:11][N:10]=[C:9]([N:13]([CH3:20])[C:14]3[CH:19]=[CH:18][CH:17]=[CH:16][CH:15]=3)[N:8]=2)[C:4]([CH3:24])=[CH:3][C:2]=1[N:1]=[CH:43][N:44]([CH2:32][CH3:42])[CH3:45]](/api/mol/svg?smiles=%5BCH3%3A23%5D%5BC%3A22%5D1%5BCH%3A21%5D%3D%5BC%3A5%5D(%5BO%3A6%5D%5BC%3A7%5D2%5BCH%3A12%5D%3D%5BCH%3A11%5D%5BN%3A10%5D%3D%5BC%3A9%5D(%5BN%3A13%5D(%5BCH3%3A20%5D)%5BC%3A14%5D3%5BCH%3A19%5D%3D%5BCH%3A18%5D%5BCH%3A17%5D%3D%5BCH%3A16%5D%5BCH%3A15%5D%3D3)%5BN%3A8%5D%3D2)%5BC%3A4%5D(%5BCH3%3A24%5D)%3D%5BCH%3A3%5D%5BC%3A2%5D%3D1%5BN%3A1%5D%3D%5BCH%3A43%5D%5BN%3A44%5D(%5BCH2%3A32%5D%5BCH3%3A42%5D)%5BCH3%3A45%5D&w=100&h=80)
![[Cl:13][C:14]1[N:19]=[C:18]([O:9][C:5]2[C:4]([CH3:10])=[CH:3][C:2]([NH2:1])=[C:7]([CH3:8])[CH:6]=2)[CH:17]=[CH:16][N:15]=1](/api/mol/svg?smiles=%5BCl%3A13%5D%5BC%3A14%5D1%5BN%3A19%5D%3D%5BC%3A18%5D(%5BO%3A9%5D%5BC%3A5%5D2%5BC%3A4%5D(%5BCH3%3A10%5D)%3D%5BCH%3A3%5D%5BC%3A2%5D(%5BNH2%3A1%5D)%3D%5BC%3A7%5D(%5BCH3%3A8%5D)%5BCH%3A6%5D%3D2)%5BCH%3A17%5D%3D%5BCH%3A16%5D%5BN%3A15%5D%3D1&w=100&h=80)
![[NH2:16][C:12]1[C:11]([CH3:17])=[CH:10][C:9]([O:8][C:6]2[CH:5]=[CH:4][N:3]=[C:2]([N:19]([CH3:18])[C:20]3[CH:25]=[CH:24][CH:23]=[CH:22][CH:21]=3)[N:7]=2)=[C:14]([CH3:15])[CH:13]=1](/api/mol/svg?smiles=%5BNH2%3A16%5D%5BC%3A12%5D1%5BC%3A11%5D(%5BCH3%3A17%5D)%3D%5BCH%3A10%5D%5BC%3A9%5D(%5BO%3A8%5D%5BC%3A6%5D2%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BN%3A3%5D%3D%5BC%3A2%5D(%5BN%3A19%5D(%5BCH3%3A18%5D)%5BC%3A20%5D3%5BCH%3A25%5D%3D%5BCH%3A24%5D%5BCH%3A23%5D%3D%5BCH%3A22%5D%5BCH%3A21%5D%3D3)%5BN%3A7%5D%3D2)%3D%5BC%3A14%5D(%5BCH3%3A15%5D)%5BCH%3A13%5D%3D1&w=100&h=80)
Dataset #12
反应 #40342
收率 45.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #40343
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40344
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40345
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40346
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40347
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40348
收率 99.9%DOI: 10.6084/m9.figshare.5104873.v1
反应 #40349
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40350
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40351
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40352
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40353
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40354
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40355
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40356
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40357
收率 88.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #40358
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40359
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40360
DOI: 10.6084/m9.figshare.5104873.v1
反应 #40361
DOI: 10.6084/m9.figshare.5104873.v1