Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LBP08E
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| Ligand Name |
(9alpha,13beta,17beta)-2-[(1z)-But-1-En-1-Yl]estra-1,3,5(10)-Triene-3,17-Diol
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| Synonyms |
(9alpha,13beta,17beta)-2-[(1z)-But-1-En-1-Yl]estra-1,3,5(10)-Triene-3,17-Diol; SCHEMBL21067508; DB07678
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| Structure |
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Download2D MOL |
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| Formula |
C22H30O2
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| Canonical SMILES |
CCC=CC1=C(C=C2CCC3C(C2=C1)CCC4(C3CCC4O)C)O
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| InChI |
1S/C22H30O2/c1-3-4-5-15-12-18-14(13-20(15)23)6-7-17-16(18)10-11-22(2)19(17)8-9-21(22)24/h4-5,12-13,16-17,19,21,23-24H,3,6-11H2,1-2H3/b5-4-/t16-,17+,19-,21-,22-/m0/s1
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| InChIKey |
ANAMDWGJXBYJEB-OPWFCKQNSA-N
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| PubChem Compound ID | ||||
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