Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LFIX73
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| Ligand Name |
(7beta,9beta,13alpha,17beta)-7-{9-[(R)-(4,4,5,5,5-Pentafluoropentyl)sulfinyl]nonyl}estra-1(10),2,4-Triene-3,17-Diol
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| Synonyms |
Fulvestrant (R enantiomer); (7beta,9beta,13alpha,17beta)-7-{9-[(R)-(4,4,5,5,5-Pentafluoropentyl)sulfinyl]nonyl}estra-1(10),2,4-Triene-3,17-Diol; SCHEMBL8210; ZINC3995809; HY-13636B; CS-8172; Q27460466; FVS
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| Structure |
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Download2D MOL |
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| Formula |
C32H47F5O3S
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| Canonical SMILES |
CC12CCC3C(C1CCC2O)C(CC4=C3C=CC(=C4)O)CCCCCCCCCS(=O)CCCC(C(F)(F)F)(F)F
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| InChI |
1S/C32H47F5O3S/c1-30-17-15-26-25-12-11-24(38)21-23(25)20-22(29(26)27(30)13-14-28(30)39)10-7-5-3-2-4-6-8-18-41(40)19-9-16-31(33,34)32(35,36)37/h11-12,21-22,26-29,38-39H,2-10,13-20H2,1H3/t22-,26-,27+,28+,29-,30+,41-/m1/s1
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| InChIKey |
VWUXBMIQPBEWFH-CIAKRVSBSA-N
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| PubChem Compound ID | ||||
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