Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LC8KL1
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| Ligand Name |
17alpha-hydroxy-7alpha-[(2Z)-4-(17beta-hydroxy-3-oxo-8alpha-androst-4-en-7beta-yl)but-2-en-1-yl]-8alpha,10alpha,13alpha,14beta-androst-4-en-3-one
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| Synonyms |
CHEMBL4863362; 17alpha-hydroxy-7alpha-[(2Z)-4-(17beta-hydroxy-3-oxo-8alpha-androst-4-en-7beta-yl)but-2-en-1-yl]-8alpha,10alpha,13alpha,14beta-androst-4-en-3-one; BDBM50576969; YNV
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| Structure |
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Download2D MOL |
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| Formula |
C42H60O4
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| Canonical SMILES |
CC12CCC3C(C1CCC2O)C(CC4=CC(=O)CCC34C)CC=CCC5CC6=CC(=O)CCC6(C7C5C8CCC(C8(CC7)C)O)C
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| InChI |
1S/C42H60O4/c1-39-17-13-29(43)23-27(39)21-25(37-31-9-11-35(45)41(31,3)19-15-33(37)39)7-5-6-8-26-22-28-24-30(44)14-18-40(28,2)34-16-20-42(4)32(38(26)34)10-12-36(42)46/h5-6,23-26,31-38,45-46H,7-22H2,1-4H3/b6-5-/t25-,26-,31+,32+,33+,34+,35+,36+,37+,38+,39+,40+,41+,42+/m1/s1
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| InChIKey |
FKJMMUCCAVJSJW-HKNCNPFKSA-N
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| PubChem Compound ID | ||||
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