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Concept information

Preferred term

5beta-cholestane-3alpha,7alpha,12alpha,24,26-pentol  

Type

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

charge

  • 0

formula

  • C27H48O5

has_parent_hydride

inchi

  • InChI=1S/C27H48O5/c1-15(5-8-22(30)16(2)14-28)19-6-7-20-25-21(13-24(32)27(19,20)4)26(3)10-9-18(29)11-17(26)12-23(25)31/h15-25,28-32H,5-14H2,1-4H3/t15-,16?,17+,18-,19-,20+,21+,22?,23-,24+,25+,26+,27-/m1/s1

inchikey

  • CPKBPCHJXMSTOE-OYYINRPOSA-N

mass

  • 452.66702

monoisotopicmass

  • 452.35017

smiles

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

subset

  • 3_STAR

synonym EXACT

  • 5beta-cholestane-3alpha,7alpha,12alpha,24,26-pentol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:48732

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