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Concept information

Preferred term

5beta-cholestane-3alpha,24,25-triol  

Type

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

Broader concept

charge

  • 0

formula

  • C27H48O3

inchi

  • InChI=1S/C27H48O3/c1-17(6-11-24(29)25(2,3)30)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h17-24,28-30H,6-16H2,1-5H3/t17-,18-,19-,20+,21-,22+,23+,24?,26+,27-/m1/s1

inchikey

  • DEZLYZBLMUAYLV-AYFKJPLJSA-N

mass

  • 420.678

monoisotopicmass

  • 420.36035

smiles

  • O[C@H]1C[C@@]2([C@@]([C@@]3([C@]([C@]4([C@@]([C@](CC4)([C@@H](CCC(O)C(O)(C)C)C)[H])(CC3)C)[H])(CC2)[H])[H])(CC1)C)[H]

subset

  • 2_STAR

synonym EXACT

  • (6R)-6-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptane-2,3-diol

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:187046

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