Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
L7K6LT
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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-7,10,14,17,21-Pentaazatricyclo[14.3.1.1~2,5~]henicosa-1(20),2(21),16,18-Tetraene-6,9,13-Trione
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Synonyms |
CHEMBL3593415; (5r,8s,11s)-5-Methyl-8-(Propan-2-Yl)-11-[(1e)-4-Sulfanylbut-1-En-1-Yl]-3-Thia-7,10,14,17,21-Pentaazatricyclo[14.3.1.1~2,5~]henicosa-1(20),2(21),16,18-Tetraene-6,9,13-Trione; L7G; BDBM50098424; Q27462310
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Structure |
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)26-16(6-4-5-9-32)11-18(29)25-12-17-10-15(7-8-24-17)21-28-23(3,13-33-21)22(31)27-19/h4,6-8,10,14,16,19,32H,5,9,11-13H2,1-3H3,(H,25,29)(H,26,30)(H,27,31)/b6-4+/t16-,19+,23+/m1/s1
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InChIKey |
KTHSULHRWFVWHD-GZGVDZSUSA-N
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PubChem Compound ID |
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