Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L6YCS8
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| Ligand Name |
[(1'R)-1'-{4-[(1-ethylazetidin-3-yl)oxy]phenyl}-6'-hydroxy-1',4'-dihydro-2'H-spiro[cyclopropane-1,3'-isoquinolin]-2'-yl](phenyl)methanone
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| Synonyms |
[(1'R)-1'-{4-[(1-ethylazetidin-3-yl)oxy]phenyl}-6'-hydroxy-1',4'-dihydro-2'H-spiro[cyclopropane-1,3'-isoquinolin]-2'-yl](phenyl)methanone; TQF
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| Structure |
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Download2D MOL |
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| Formula |
C29H30N2O3
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| Canonical SMILES |
CCN1CC(C1)OC2=CC=C(C=C2)C3C4=C(CC5(N3C(=O)C6=CC=CC=C6)CC5)C=C(C=C4)O
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| InChI |
1S/C29H30N2O3/c1-2-30-18-25(19-30)34-24-11-8-20(9-12-24)27-26-13-10-23(32)16-22(26)17-29(14-15-29)31(27)28(33)21-6-4-3-5-7-21/h3-13,16,25,27,32H,2,14-15,17-19H2,1H3/t27-/m1/s1
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| InChIKey |
KYSPUCBQKNTERK-HHHXNRCGSA-N
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| PubChem Compound ID | ||||
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