0  B29R3.60360606  C/C=C/C1=C(N2C(=O)[C@H]([C@H]2SC1)NC(=O)[C@H](N)C3=CC=C(C=C3)O)C(=O)O MCULE-8482198459 [0,0,0,0,0,0|0,0,0]=0
1  B29R3.60360606  C/C=C\C1=C(N2C(=O)[C@H]([C@H]2SC1)NC(=O)[C@H](N)C3=CC=C(C=C3)O)C(=O)O MCULE-7224160199 [0,0,0,0,0,0|0,0,0]=0
2  B29R3.60360606  CC=CC1=C(N2C(=O)C(C2SC1)NC(=O)C(N)C3=CC=C(C=C3)O)C(=O)O MCULE-6670719347 [0,0,0,0,0,0|0,0,0]=0
3  B29R3.60360606  CC=CC1=C(N2C(=O)[C@H]([C@H]2SC1)NC(=O)[C@H](N)C3=CC=C(C=C3)O)C(=O)O MCULE-2499631633 [0,0,0,0,0,0|0,0,0]=0
4  B29R3.60360606  [C@@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)[C@H](N)C3=CC=C(C=C3)O)C(=O)O)/C=C/C MCULE-9792342723 [0,0,0,0,0,0|0,0,0]=0
5  B29R3.60360606  [C@@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)[C@H](N)C3=CC=C(C=C3)O)C(=O)O)C=CC MCULE-2688310388 [0,0,0,0,0,0|0,0,0]=0
6  B27R3.75019564  [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)C(N)C3=CC=CC=C3)C(=O)O)CO MCULE-4273786575 [2,0,0,0,0,0|1,0,1]=4
7  B27R3.368466829  C12SCC(=C(N1C(=O)C2NC(=O)C(N)C3=CC=C(C=C3)O)C(=O)O)C MCULE-6662086355 [2,0,0,0,0,0|0,0,0]=2
8  B27R3.368466829  CC1=C(N2C(=O)[C@H]([C@H]2SC1)NC(=O)[C@H](N)C3=CC=C(C=C3)O)C(=O)O MCULE-7729282935 [2,0,0,0,0,0|0,0,0]=2
9  B27R3.368466829  CC1=CS[C@@H]2[C@@H](C(=O)N2C1C(=O)O)NC(=O)[C@H](N)C3=CC=C(C=C3)O MCULE-3318378298 [2,0,0,0,0,0|0,0,2]=4
10  B27R3.368466829  [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)C(N)C3=CC=C(C=C3)O)C(=O)O)C MCULE-5879011146 [2,0,0,0,0,0|0,0,0]=2
11  B27R3.368466829  [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)[C@H](N)C3=CC=C(C=C3)O)C(=O)O)C MCULE-6475996520 [2,0,0,0,0,0|0,0,0]=2