Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LC0DI4
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| Ligand Name |
(1S,2R,4S)-N-[4-(benzyloxy)phenyl]-5,6-bis(4-hydroxyphenyl)-N-(2,2,2-trifluoroethyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-sulfonamide
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| Synonyms |
(1S,2R,4S)-N-[4-(benzyloxy)phenyl]-5,6-bis(4-hydroxyphenyl)-N-(2,2,2-trifluoroethyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-sulfonamide
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| Structure |
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Download2D MOL |
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| Formula |
C33H28F3NO6S
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| Canonical SMILES |
C1C(C2C(=C(C1O2)C3=CC=C(C=C3)O)C4=CC=C(C=C4)O)S(=O)(=O)N(CC(F)(F)F)C5=CC=C(C=C5)OCC6=CC=CC=C6
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| InChI |
1S/C33H28F3NO6S/c34-33(35,36)20-37(24-10-16-27(17-11-24)42-19-21-4-2-1-3-5-21)44(40,41)29-18-28-30(22-6-12-25(38)13-7-22)31(32(29)43-28)23-8-14-26(39)15-9-23/h1-17,28-29,32,38-39H,18-20H2/t28-,29+,32+/m0/s1
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| InChIKey |
PSRAECSNIYRUSM-NPLMNSEMSA-N
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| PubChem Compound ID | ||||
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