Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L9ZIY6
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| Ligand Name |
(5r,8s,11s)-5-Methyl-8-(Propan-2-Yl)-11-[(1e)-4-Sulfanylbut-1-En-1-Yl]-3-Thia-7,10,14,20,21-Pentaazatricyclo[14.3.1.1~2,5~]henicosa-1(20),2(21),16,18-Tetraene-6,9,13-Trione
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| Synonyms |
CHEMBL3593413; (5r,8s,11s)-5-Methyl-8-(Propan-2-Yl)-11-[(1e)-4-Sulfanylbut-1-En-1-Yl]-3-Thia-7,10,14,20,21-Pentaazatricyclo[14.3.1.1~2,5~]henicosa-1(20),2(21),16,18-Tetraene-6,9,13-Trione; L8G; BDBM50098422; Q27462319
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| Structure |
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Download2D MOL |
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| Formula |
C23H31N5O3S2
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| Canonical SMILES |
CC(C)C1C(=O)NC(CC(=O)NCC2=NC(=CC=C2)C3=NC(CS3)(C(=O)N1)C)C=CCCS
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| InChI |
1S/C23H31N5O3S2/c1-14(2)19-20(30)26-15(7-4-5-10-32)11-18(29)24-12-16-8-6-9-17(25-16)21-28-23(3,13-33-21)22(31)27-19/h4,6-9,14-15,19,32H,5,10-13H2,1-3H3,(H,24,29)(H,26,30)(H,27,31)/b7-4+/t15-,19+,23+/m1/s1
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| InChIKey |
PFXMQZVRILDSDW-XUFAZQDHSA-N
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| PubChem Compound ID | ||||
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