Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LD50BR
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| Ligand Name |
1-[7,7-Bis(oxidanyl)-8-oxa-7-boranuidabicyclo[4.3.0]nona-1(6),2,4-trien-4-yl]-3-(phenylmethyl)thiourea
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| Synonyms |
1-[7,7-bis(oxidanyl)-8-oxa-7-boranuidabicyclo[4.3.0]nona-1(6),2,4-trien-4-yl]-3-(phenylmethyl)thiourea; KL5
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| Structure |
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Download2D MOL
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| Formula |
C15H16BN2O3S-
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| Canonical SMILES |
[B-]1(C2=C(CO1)C=CC(=C2)NC(=S)NCC3=CC=CC=C3)(O)O
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| InChI |
1S/C15H16BN2O3S/c19-16(20)14-8-13(7-6-12(14)10-21-16)18-15(22)17-9-11-4-2-1-3-5-11/h1-8,19-20H,9-10H2,(H2,17,18,22)/q-1
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| InChIKey |
PURMMQOEOOZDEQ-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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