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Concept information

Preferred term

(16s)-hydroxy-22-oxocholesterol  

Type

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

charge

  • 0

formula

  • C27H44O3

has_functional_parent

inchi

  • InChI=1S/C27H44O3/c1-16(2)6-9-23(29)17(3)25-24(30)15-22-20-8-7-18-14-19(28)10-12-26(18,4)21(20)11-13-27(22,25)5/h7,16-17,19-22,24-25,28,30H,6,8-15H2,1-5H3/t17-,19+,20-,21+,22+,24+,25+,26+,27+/m1/s1

inchikey

  • VTNZQXZPUYPXFT-AHWSEQNHSA-N

mass

  • 416.646

monoisotopicmass

  • 416.32905

smiles

  • [H][C@@]12C[C@H](O)[C@]([H])([C@H](C)C(=O)CCC(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C

subset

  • 3_STAR

synonym EXACT

  • (16S)-hydroxy-22-oxocholesterol
  • 3beta,16beta-dihydroxycholest-5-en-22-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:191941

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