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Concept information

... > organooxygen compound > carbonyl compound > ketone > oxo steroid > oxo seco-steroid > oxocalciol > (1s)-1,23-dihydroxy-24,25,26,27-tetranorcalciol

Preferred term

(1s)-1,23-dihydroxy-24,25,26,27-tetranorcalciol  

Type

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

charge

  • 0

formula

  • C23H36O3

inchi

  • InChI=1S/C23H36O3/c1-15(10-12-24)20-8-9-21-17(5-4-11-23(20,21)3)6-7-18-13-19(25)14-22(26)16(18)2/h6-7,15,19-22,24-26H,2,4-5,8-14H2,1,3H3/b17-6+,18-7-/t15-,19-,20-,21+,22+,23-/m1/s1

inchikey

  • QKSLGXKBRJBRQD-NKLFQLIUSA-N

mass

  • 360.53014

monoisotopicmass

  • 360.26645

smiles

  • [H][C@@]1(CC[C@@]2([H])/C(CCC[C@]12C)=C/C=C1/C[C@@H](O)C[C@H](O)C1=C)[C@H](C)CCO

subset

  • 3_STAR

synonym EXACT

  • (1S)-1,23-dihydroxy-24,25,26,27-tetranorcalciol
  • (1S,3R,5Z,7E)-24-nor-9,10-secochola-5,7,10(19)-triene-1,3,23-triol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:47818

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