Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LBJQ45
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| Ligand Name |
1-(1,1-dihydroxy-3H-2,1-benzoxaborol-1-ium-6-yl)-3-phenylthiourea
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| Structure |
 |
Download2D MOL
|
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| Formula |
C14H14BN2O3S+
|
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| Canonical SMILES |
[B+]1(C2=C(CO1)C=CC(=C2)NC(=S)NC3=CC=CC=C3)(O)O
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| InChI |
1S/C14H14BN2O3S/c18-15(19)13-8-12(7-6-10(13)9-20-15)17-14(21)16-11-4-2-1-3-5-11/h1-8,18-19H,9H2,(H2,16,17,21)/q+1
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| InChIKey |
VRVPPCOJDHKCRT-UHFFFAOYSA-N
|
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| PubChem Compound ID | ||||
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