Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L5AH2S
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| Ligand Name |
(2S)-6-(4-aminopiperazin-1-yl)-11-carboxy-7-fluoro-2-methyl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,9,11-tetraen-10-olate
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| Structure |
 |
Download2D MOL |
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| Formula |
C17H20FN4O4-
|
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| Canonical SMILES |
CC1COC2=C3N1C=C(C(=C3CC(=C2N4CCN(CC4)N)F)[O-])C(=O)O
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| InChI |
1S/C17H21FN4O4/c1-9-8-26-16-13-10(15(23)11(17(24)25)7-22(9)13)6-12(18)14(16)20-2-4-21(19)5-3-20/h7,9,23H,2-6,8,19H2,1H3,(H,24,25)/p-1/t9-/m0/s1
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| InChIKey |
XSSSNYCVNIDBIB-VIFPVBQESA-M
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| PubChem Compound ID | ||||
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