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Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > 3-oxo steroid > 3-oxo-5beta-steroid > 7alpha,24-dihydroxy-5beta-cholestan-3-one
... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 3-oxo steroid > 3-oxo-5beta-steroid > 7alpha,24-dihydroxy-5beta-cholestan-3-one

Preferred term

7alpha,24-dihydroxy-5beta-cholestan-3-one  

Type

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

charge

  • 0

formula

  • C27H46O3

has_parent_hydride

inchi

  • InChI=1S/C27H46O3/c1-16(2)23(29)9-6-17(3)20-7-8-21-25-22(11-13-27(20,21)5)26(4)12-10-19(28)14-18(26)15-24(25)30/h16-18,20-25,29-30H,6-15H2,1-5H3/t17-,18+,20-,21+,22+,23?,24-,25+,26+,27-/m1/s1

inchikey

  • FGKQZAUZOBFLBY-YUOMIZQASA-N

mass

  • 418.65234

monoisotopicmass

  • 418.34470

smiles

  • [H][C@]12C[C@@H](O)[C@@]3([H])[C@]4([H])CC[C@]([H])([C@H](C)CCC(O)C(C)C)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CCC(=O)C2

subset

  • 3_STAR

synonym EXACT

  • 7alpha,24alpha-dihydroxy-5beta-cholestan-3-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:48698

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