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Concept information

Preferred term

5beta-cholestane-3alpha,7alpha,12alpha,25-tetrol  

Type

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

charge

  • 0

formula

  • C27H48O4

has_parent_hydride

inchi

  • InChI=1S/C27H48O4/c1-16(7-6-11-25(2,3)31)19-8-9-20-24-21(15-23(30)27(19,20)5)26(4)12-10-18(28)13-17(26)14-22(24)29/h16-24,28-31H,6-15H2,1-5H3/t16-,17+,18-,19-,20+,21+,22-,23+,24+,26+,27-/m1/s1

inchikey

  • NTIXPPFPXLYJCT-RNUSRIHUSA-N

mass

  • 436.677

monoisotopicmass

  • 436.35526

smiles

  • C1[C@@]2([C@]3(C[C@@H]([C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])O)[H])(CC[C@@]4([C@@H](CCCC(C)(C)O)C)[H])[H])C)O)[H])C

subset

  • 2_STAR

synonym EXACT

  • 5beta-cholestane-3alpha,7alpha,12alpha,25-tetrol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:169973

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