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Concept information

Preferred term

(5z,7e)-(3s)-25-fluoro-9,10-seco-5,7,10(19)-cholestatrien-3-ol  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C27H43FO

inchi

  • InChI=1S/C27H43FO/c1-19-10-13-23(29)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)28/h11-12,20,23-25,29H,1,6-10,13-18H2,2-5H3/b21-11+,22-12-/t20-,23+,24-,25+,27-/m1/s1

inchikey

  • YLVZXKUOEBIAHY-DTOXIADCSA-N

mass

  • 402.638

monoisotopicmass

  • 402.32979

smiles

  • FC(CCC[C@H]([C@@]1([C@@]2([C@@](CC1)(/C(/CCC2)=C/C=C/3/C[C@@H](O)CCC3=C)[H])C)[H])C)(C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-luoro-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:173070

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