skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > 3-oxo steroid > 3-oxo-5beta-steroid > 7alpha,26-dihydroxy-5beta-cholestan-3-one
... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 3-oxo steroid > 3-oxo-5beta-steroid > 7alpha,26-dihydroxy-5beta-cholestan-3-one

Preferred term

7alpha,26-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/c1-17(16-28)6-5-7-18(2)21-8-9-22-25-23(11-13-27(21,22)4)26(3)12-10-20(29)14-19(26)15-24(25)30/h17-19,21-25,28,30H,5-16H2,1-4H3/t17?,18-,19+,21-,22+,23+,24-,25+,26+,27-/m1/s1

inchikey

  • HXGWUGDCIVSGLK-QOXJXTBWSA-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)CCCC(C)CO)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CCC(=O)C2

subset

  • 3_STAR

synonym EXACT

  • 7alpha,26-dihydroxy-5beta-cholestan-3-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:48778

Download this concept: