← 浏览数据集![[CH3:59][C:58]([NH:61][C@H:62]1[CH:63]([OH:64])[O:65][C@H:66]([CH2:82][OH:83])[C@@H:67]([O:70][C@@H:71]2[O:79][C@H:78]([CH2:80][OH:81])[C@H:76]([OH:77])[C@H:74]([OH:75])[C@H:72]2[OH:73])[C@@H:68]1[OH:69])=[O:60]](/api/mol/svg?smiles=%5BCH3%3A59%5D%5BC%3A58%5D(%5BNH%3A61%5D%5BC%40H%3A62%5D1%5BCH%3A63%5D(%5BOH%3A64%5D)%5BO%3A65%5D%5BC%40H%3A66%5D(%5BCH2%3A82%5D%5BOH%3A83%5D)%5BC%40%40H%3A67%5D(%5BO%3A70%5D%5BC%40%40H%3A71%5D2%5BO%3A79%5D%5BC%40H%3A78%5D(%5BCH2%3A80%5D%5BOH%3A81%5D)%5BC%40H%3A76%5D(%5BOH%3A77%5D)%5BC%40H%3A74%5D(%5BOH%3A75%5D)%5BC%40H%3A72%5D2%5BOH%3A73%5D)%5BC%40%40H%3A68%5D1%5BOH%3A69%5D)%3D%5BO%3A60%5D&w=100&h=80)
[C@@H:15]1[O:29][C@H:19]([CH2:20][O:21][Si:22]([C:25]([CH3:26])([CH3:27])[CH3:28])([CH3:24])[CH3:23])[C@@H:17]([O:18][CH2:34][S:35][CH3:37])[CH2:16]1)(=[O:8])[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1](/api/mol/svg?smiles=%5BC%3A1%5D(%5BNH%3A9%5D%5BC%3A10%5D1%5BC%3A11%5D2%5BN%3A12%5D%3D%5BCH%3A13%5D%5BN%3A14%5D(%5BC%3A30%5D%3D2%5BN%3A31%5D%3D%5BCH%3A32%5D%5BN%3A33%5D%3D1)%5BC%40%40H%3A15%5D1%5BO%3A29%5D%5BC%40H%3A19%5D(%5BCH2%3A20%5D%5BO%3A21%5D%5BSi%3A22%5D(%5BC%3A25%5D(%5BCH3%3A26%5D)(%5BCH3%3A27%5D)%5BCH3%3A28%5D)(%5BCH3%3A24%5D)%5BCH3%3A23%5D)%5BC%40%40H%3A17%5D(%5BO%3A18%5D%5BCH2%3A34%5D%5BS%3A35%5D%5BCH3%3A37%5D)%5BCH2%3A16%5D1)(%3D%5BO%3A8%5D)%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)
[C@@H:15]1[O:32][C@H:22]([CH2:23][OH:24])[C@@H:17]([O:18][CH2:19][N:76]=[N+:77]=[N-:78])[CH2:16]1)(=[O:8])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1](/api/mol/svg?smiles=%5BC%3A1%5D(%5BNH%3A9%5D%5BC%3A10%5D1%5BC%3A11%5D2%5BN%3A12%5D%3D%5BCH%3A13%5D%5BN%3A14%5D(%5BC%3A33%5D%3D2%5BN%3A34%5D%3D%5BCH%3A35%5D%5BN%3A36%5D%3D1)%5BC%40%40H%3A15%5D1%5BO%3A32%5D%5BC%40H%3A22%5D(%5BCH2%3A23%5D%5BOH%3A24%5D)%5BC%40%40H%3A17%5D(%5BO%3A18%5D%5BCH2%3A19%5D%5BN%3A76%5D%3D%5BN%2B%3A77%5D%3D%5BN-%3A78%5D)%5BCH2%3A16%5D1)(%3D%5BO%3A8%5D)%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BCH%3A3%5D%3D1&w=100&h=80)
([CH3:26])[CH3:27])([CH3:23])[CH3:22])[C@@H:16]([O:17][CH2:32][S:33][CH3:35])[CH2:15]2)[C:12](=[O:31])[N:11]=1)(=[O:8])[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1](/api/mol/svg?smiles=%5BC%3A1%5D(%5BNH%3A9%5D%5BC%3A10%5D1%5BCH%3A30%5D%3D%5BCH%3A29%5D%5BN%3A13%5D(%5BC%40%40H%3A14%5D2%5BO%3A28%5D%5BC%40H%3A18%5D(%5BCH2%3A19%5D%5BO%3A20%5D%5BSi%3A21%5D(%5BC%3A24%5D(%5BCH3%3A25%5D)(%5BCH3%3A26%5D)%5BCH3%3A27%5D)(%5BCH3%3A23%5D)%5BCH3%3A22%5D)%5BC%40%40H%3A16%5D(%5BO%3A17%5D%5BCH2%3A32%5D%5BS%3A33%5D%5BCH3%3A35%5D)%5BCH2%3A15%5D2)%5BC%3A12%5D(%3D%5BO%3A31%5D)%5BN%3A11%5D%3D1)(%3D%5BO%3A8%5D)%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)
[N:36]([C:37]2[CH:42]=[CH:41][CH:40]=[CH:39][CH:38]=2)[C:43]2[CH:44]=[CH:45][CH:46]=[CH:47][CH:48]=2)[C:10]2[N:11]=[CH:12][N:13]([C:32]=2[N:33]=1)[C@@H:14]1[O:31][C@H:21]([CH2:22][OH:23])[C@@H:16]([O:17][CH2:18][N:56]=[N+:57]=[N-:58])[CH2:15]1)(=[O:5])[CH:2]([CH3:4])[CH3:3]](/api/mol/svg?smiles=%5BC%3A1%5D(%5BNH%3A6%5D%5BC%3A7%5D1%5BN%3A8%5D%3D%5BC%3A9%5D(%5BO%3A34%5D%5BC%3A35%5D(%3D%5BO%3A49%5D)%5BN%3A36%5D(%5BC%3A37%5D2%5BCH%3A42%5D%3D%5BCH%3A41%5D%5BCH%3A40%5D%3D%5BCH%3A39%5D%5BCH%3A38%5D%3D2)%5BC%3A43%5D2%5BCH%3A44%5D%3D%5BCH%3A45%5D%5BCH%3A46%5D%3D%5BCH%3A47%5D%5BCH%3A48%5D%3D2)%5BC%3A10%5D2%5BN%3A11%5D%3D%5BCH%3A12%5D%5BN%3A13%5D(%5BC%3A32%5D%3D2%5BN%3A33%5D%3D1)%5BC%40%40H%3A14%5D1%5BO%3A31%5D%5BC%40H%3A21%5D(%5BCH2%3A22%5D%5BOH%3A23%5D)%5BC%40%40H%3A16%5D(%5BO%3A17%5D%5BCH2%3A18%5D%5BN%3A56%5D%3D%5BN%2B%3A57%5D%3D%5BN-%3A58%5D)%5BCH2%3A15%5D1)(%3D%5BO%3A5%5D)%5BCH%3A2%5D(%5BCH3%3A4%5D)%5BCH3%3A3%5D&w=100&h=80)
=[O:14])([CH2:32][C:33]([O:35][CH2:36][CH3:37])=[O:34])[C:18]([O:20][CH2:21][CH3:22])=[O:19])=[O:10])[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BO%3A8%5D%5BC%3A9%5D(%5BNH%3A11%5D%5BC%3A12%5D(%5BC%3A13%5D(%5BO%3A15%5D%5BCH2%3A16%5D%5BCH3%3A17%5D)%3D%5BO%3A14%5D)(%5BCH2%3A32%5D%5BC%3A33%5D(%5BO%3A35%5D%5BCH2%3A36%5D%5BCH3%3A37%5D)%3D%5BO%3A34%5D)%5BC%3A18%5D(%5BO%3A20%5D%5BCH2%3A21%5D%5BCH3%3A22%5D)%3D%5BO%3A19%5D)%3D%5BO%3A10%5D)%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)
=[O:14])([CH2:26][C:27]([O:29][CH2:30][CH3:31])=[O:28])[C:18]([O:20][CH2:21][CH3:22])=[O:19])=[O:10])[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BO%3A8%5D%5BC%3A9%5D(%5BNH%3A11%5D%5BC%3A12%5D(%5BC%3A13%5D(%5BO%3A15%5D%5BCH2%3A16%5D%5BCH3%3A17%5D)%3D%5BO%3A14%5D)(%5BCH2%3A26%5D%5BC%3A27%5D(%5BO%3A29%5D%5BCH2%3A30%5D%5BCH3%3A31%5D)%3D%5BO%3A28%5D)%5BC%3A18%5D(%5BO%3A20%5D%5BCH2%3A21%5D%5BCH3%3A22%5D)%3D%5BO%3A19%5D)%3D%5BO%3A10%5D)%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)
[NH2:35])([CH2:13][C:14]([O:16][CH2:17][CH3:18])=[O:15])[C:22]([O:24][CH2:25][CH3:26])=[O:23])=[O:10])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BO%3A8%5D%5BC%3A9%5D(%5BNH%3A11%5D%5BC%40%40%3A12%5D(%5BC%3A19%5D(%3D%5BO%3A20%5D)%5BNH2%3A35%5D)(%5BCH2%3A13%5D%5BC%3A14%5D(%5BO%3A16%5D%5BCH2%3A17%5D%5BCH3%3A18%5D)%3D%5BO%3A15%5D)%5BC%3A22%5D(%5BO%3A24%5D%5BCH2%3A25%5D%5BCH3%3A26%5D)%3D%5BO%3A23%5D)%3D%5BO%3A10%5D)%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BCH%3A3%5D%3D1&w=100&h=80)
=[O:14])[CH2:18][C:19](=[O:20])[NH:25][C:24]1=[O:26])=[O:10])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BO%3A8%5D%5BC%3A9%5D(%5BNH%3A11%5D%5BC%40%3A12%5D1(%5BC%3A13%5D(%5BO%3A15%5D%5BCH2%3A16%5D%5BCH3%3A17%5D)%3D%5BO%3A14%5D)%5BCH2%3A18%5D%5BC%3A19%5D(%3D%5BO%3A20%5D)%5BNH%3A25%5D%5BC%3A24%5D1%3D%5BO%3A26%5D)%3D%5BO%3A10%5D)%5BC%3A2%5D1%5BCH%3A7%5D%3D%5BCH%3A6%5D%5BCH%3A5%5D%3D%5BCH%3A4%5D%5BCH%3A3%5D%3D1&w=100&h=80)
![[NH2:11][C@:12]1([C:19]([O:21][CH2:22][CH3:23])=[O:20])[CH2:17][C:16](=[O:18])[NH:15][C:13]1=[O:14]](/api/mol/svg?smiles=%5BNH2%3A11%5D%5BC%40%3A12%5D1(%5BC%3A19%5D(%5BO%3A21%5D%5BCH2%3A22%5D%5BCH3%3A23%5D)%3D%5BO%3A20%5D)%5BCH2%3A17%5D%5BC%3A16%5D(%3D%5BO%3A18%5D)%5BNH%3A15%5D%5BC%3A13%5D1%3D%5BO%3A14%5D&w=100&h=80)
[CH:25]=[CH2:30]](/api/mol/svg?smiles=%5BCH2%3A24%5D(%5BN%3A27%5D%3D%5BC%3A1%5D%3D%5BS%3A7%5D)%5BCH%3A25%5D%3D%5BCH2%3A30%5D&w=100&h=80)
[CH:2]=[CH2:3]](/api/mol/svg?smiles=%5BCH2%3A1%5D(%5BN%3A4%5D%3D%5BC%3A5%5D%3D%5BS%3A6%5D)%5BCH%3A2%5D%3D%5BCH2%3A3%5D&w=100&h=80)
![[Br-:8]](/api/mol/svg?smiles=%5BBr-%3A8%5D&w=100&h=80)
![[Cl-:8]](/api/mol/svg?smiles=%5BCl-%3A8%5D&w=100&h=80)
![[Cl-:8]](/api/mol/svg?smiles=%5BCl-%3A8%5D&w=100&h=80)
![[CH3:5][O:4][C:2]([NH:6][C@H:7]([C:15]1[CH:16]=[CH:17][CH:18]=[CH:19][CH:20]=1)[C:8]([O:10][C:11]([CH3:14])([CH3:13])[CH3:12])=[O:9])=[O:3]](/api/mol/svg?smiles=%5BCH3%3A5%5D%5BO%3A4%5D%5BC%3A2%5D(%5BNH%3A6%5D%5BC%40H%3A7%5D(%5BC%3A15%5D1%5BCH%3A16%5D%3D%5BCH%3A17%5D%5BCH%3A18%5D%3D%5BCH%3A19%5D%5BCH%3A20%5D%3D1)%5BC%3A8%5D(%5BO%3A10%5D%5BC%3A11%5D(%5BCH3%3A14%5D)(%5BCH3%3A13%5D)%5BCH3%3A12%5D)%3D%5BO%3A9%5D)%3D%5BO%3A3%5D&w=100&h=80)
![[C:24]1([CH:13]([O:12][S:7]([C:4]2[CH:5]=[CH:6][C:1]([CH3:11])=[CH:2][CH:3]=2)(=[O:9])=[O:8])[C:14]([O:16][CH2:17][C:18]2[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=2)=[O:15])[CH:29]=[CH:28][CH:27]=[CH:26][CH:25]=1](/api/mol/svg?smiles=%5BC%3A24%5D1(%5BCH%3A13%5D(%5BO%3A12%5D%5BS%3A7%5D(%5BC%3A4%5D2%5BCH%3A5%5D%3D%5BCH%3A6%5D%5BC%3A1%5D(%5BCH3%3A11%5D)%3D%5BCH%3A2%5D%5BCH%3A3%5D%3D2)(%3D%5BO%3A9%5D)%3D%5BO%3A8%5D)%5BC%3A14%5D(%5BO%3A16%5D%5BCH2%3A17%5D%5BC%3A18%5D2%5BCH%3A23%5D%3D%5BCH%3A22%5D%5BCH%3A21%5D%3D%5BCH%3A20%5D%5BCH%3A19%5D%3D2)%3D%5BO%3A15%5D)%5BCH%3A29%5D%3D%5BCH%3A28%5D%5BCH%3A27%5D%3D%5BCH%3A26%5D%5BCH%3A25%5D%3D1&w=100&h=80)
![[CH3:29][N:30]1[CH2:35][CH2:34][N:33]([CH:7]([C:1]2[CH:2]=[CH:3][CH:4]=[CH:5][CH:6]=2)[C:8]([O:10][CH2:11][C:12]2[CH:13]=[CH:14][CH:15]=[CH:16][CH:17]=2)=[O:9])[CH2:32][CH2:31]1](/api/mol/svg?smiles=%5BCH3%3A29%5D%5BN%3A30%5D1%5BCH2%3A35%5D%5BCH2%3A34%5D%5BN%3A33%5D(%5BCH%3A7%5D(%5BC%3A1%5D2%5BCH%3A2%5D%3D%5BCH%3A3%5D%5BCH%3A4%5D%3D%5BCH%3A5%5D%5BCH%3A6%5D%3D2)%5BC%3A8%5D(%5BO%3A10%5D%5BCH2%3A11%5D%5BC%3A12%5D2%5BCH%3A13%5D%3D%5BCH%3A14%5D%5BCH%3A15%5D%3D%5BCH%3A16%5D%5BCH%3A17%5D%3D2)%3D%5BO%3A9%5D)%5BCH2%3A32%5D%5BCH2%3A31%5D1&w=100&h=80)
![[O:16]1[CH2:17][CH2:18][N:13]([CH2:2][C:3]2[CH:8]=[CH:7][CH:6]=[CH:5][C:4]=2[CH2:9][C:10]([OH:12])=[O:11])[CH2:14][CH2:15]1](/api/mol/svg?smiles=%5BO%3A16%5D1%5BCH2%3A17%5D%5BCH2%3A18%5D%5BN%3A13%5D(%5BCH2%3A2%5D%5BC%3A3%5D2%5BCH%3A8%5D%3D%5BCH%3A7%5D%5BCH%3A6%5D%3D%5BCH%3A5%5D%5BC%3A4%5D%3D2%5BCH2%3A9%5D%5BC%3A10%5D(%5BOH%3A12%5D)%3D%5BO%3A11%5D)%5BCH2%3A14%5D%5BCH2%3A15%5D1&w=100&h=80)
![[NH2:12][C@@H:8]([CH2:7][CH2:6][N:3]([CH2:2][CH3:24])[CH2:20][CH3:21])[C:9]([OH:11])=[O:10]](/api/mol/svg?smiles=%5BNH2%3A12%5D%5BC%40%40H%3A8%5D(%5BCH2%3A7%5D%5BCH2%3A6%5D%5BN%3A3%5D(%5BCH2%3A2%5D%5BCH3%3A24%5D)%5BCH2%3A20%5D%5BCH3%3A21%5D)%5BC%3A9%5D(%5BOH%3A11%5D)%3D%5BO%3A10%5D&w=100&h=80)
Dataset #316
反应 #1483145
DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483146
收率 71.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483147
收率 48.1%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483148
收率 73.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483149
收率 36.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483150
收率 86.1%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483151
收率 87.3%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483152
收率 84.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483153
收率 85.2%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483154
收率 93.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483155
DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483156
DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483157
收率 72.4%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483158
收率 24.1%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483159
收率 11.0%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483160
收率 71.6%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483161
DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483162
收率 93.1%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483163
收率 87.4%DOI: 10.6084/m9.figshare.5104873.v1
反应 #1483164
DOI: 10.6084/m9.figshare.5104873.v1