Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L3MC5A
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| Ligand Name |
{(1'R)-6'-hydroxy-1'-[4-({[(3S)-1-propylpyrrolidin-3-yl]methyl}sulfanyl)phenyl]-1',4'-dihydro-2'H-spiro[cyclopropane-1,3'-isoquinolin]-2'-yl}(phenyl)methanone
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| Synonyms |
{(1'R)-6'-hydroxy-1'-[4-({[(3S)-1-propylpyrrolidin-3-yl]methyl}sulfanyl)phenyl]-1',4'-dihydro-2'H-spiro[cyclopropane-1,3'-isoquinolin]-2'-yl}(phenyl)methanone; TZ3
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| Structure |
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Download2D MOL |
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| Formula |
C32H36N2O2S
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| Canonical SMILES |
CCCN1CCC(C1)CSC2=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/C32H36N2O2S/c1-2-17-33-18-14-23(21-33)22-37-28-11-8-24(9-12-28)30-29-13-10-27(35)19-26(29)20-32(15-16-32)34(30)31(36)25-6-4-3-5-7-25/h3-13,19,23,30,35H,2,14-18,20-22H2,1H3/t23-,30+/m0/s1
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| InChIKey |
FFOWVMHPRGKVKO-YUDQIZAISA-N
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| PubChem Compound ID | ||||
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