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Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > 3-oxo steroid > 3-oxo-5alpha-steroid > 7alpha,12alpha-dihydroxy-5alpha-cholestan-3-one
... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 3-oxo steroid > 3-oxo-5alpha-steroid > 7alpha,12alpha-dihydroxy-5alpha-cholestan-3-one

Preferred term

7alpha,12alpha-dihydroxy-5alpha-cholestan-3-one  

Type

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

charge

  • 0

formula

  • C27H46O3

inchi

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

inchikey

  • HHVQPBXBALLUDF-SVWKRCSNSA-N

mass

  • 418.653

monoisotopicmass

  • 418.34470

smiles

  • CC(C)CCCC(C)C1CCC2C3[C@H](O)C[C@H]4CC(=O)CCC4(C)C3C[C@H](O)C12C

subset

  • 2_STAR

synonym EXACT

  • 7alpha,12alpha-Dihydroxy-5alpha-cholestan-3-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:2287

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